Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.

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Dibenzoyl peroxide, 97% (dry wt.), wet with 25% water

CAS: 94-36-0 Molecular Formula: C14H10O4 Molecular Weight (g/mol): 242.23 MDL Number: MFCD00003071 InChI Key: OMPJBNCRMGITSC-UHFFFAOYSA-N Synonym: benzoyl peroxide,dibenzoyl peroxide,peroxide, dibenzoyl,benzoperoxide,benzoyl superoxide,acetoxyl,lucidol,benoxyl,panoxyl,benzol peroxide PubChem CID: 7187 ChEBI: CHEBI:82405 IUPAC Name: benzoyl benzenecarboperoxoate SMILES: C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC=C2

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PubChem CID	7187
CAS	94-36-0
Molecular Weight (g/mol)	242.23
ChEBI	CHEBI:82405
MDL Number	MFCD00003071
SMILES	C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC=C2
Synonym	benzoyl peroxide,dibenzoyl peroxide,peroxide, dibenzoyl,benzoperoxide,benzoyl superoxide,acetoxyl,lucidol,benoxyl,panoxyl,benzol peroxide
IUPAC Name	benzoyl benzenecarboperoxoate
InChI Key	OMPJBNCRMGITSC-UHFFFAOYSA-N
Molecular Formula	C14H10O4

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Dibenzoyl peroxide, 75%, remainder water

CAS: 94-36-0 Molecular Formula: C₁₄H₁₀O₄ Molecular Weight (g/mol): 242.23 MDL Number: MFCD00003071 InChI Key: OMPJBNCRMGITSC-UHFFFAOYSA-N Synonym: benzoyl peroxide,dibenzoyl peroxide,peroxide, dibenzoyl,benzoperoxide,benzoyl superoxide,acetoxyl,lucidol,benoxyl,panoxyl,benzol peroxide PubChem CID: 7187 ChEBI: CHEBI:82405 IUPAC Name: benzoyl benzenecarboperoxoate SMILES: C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC=C2

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PubChem CID	7187
CAS	94-36-0
Molecular Weight (g/mol)	242.23
ChEBI	CHEBI:82405
MDL Number	MFCD00003071
SMILES	C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC=C2
Synonym	benzoyl peroxide,dibenzoyl peroxide,peroxide, dibenzoyl,benzoperoxide,benzoyl superoxide,acetoxyl,lucidol,benoxyl,panoxyl,benzol peroxide
IUPAC Name	benzoyl benzenecarboperoxoate
InChI Key	OMPJBNCRMGITSC-UHFFFAOYSA-N
Molecular Formula	C₁₄H₁₀O₄

3-Chloroperoxybenzoic Acid, 70-75%, balance 3-Chlorobenzoic Acid and water

3-Chloroperoxybenzoic acid, 70-75%, C7H5ClO3, CAS Number-937-14-4, 535-80-8, 7732-18-5 | CAS: 937-14-4 | C7H5ClO3 | 172.56 g/mol

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Linear Formula	ClC₆H₄CO₃H
Molecular Weight (g/mol)	172.56
ChEBI	CHEBI:52091
CAS Min %	25.0
InChI Key	NHQDETIJWKXCTC-UHFFFAOYSA-N
Density	0.5600g/mL
PubChem CID	70297
Name Note	70 - 75%
Percent Purity	70-75%
Fieser	01,135; 02,68; 03,49; 04,85; 05,120; 06,110; 07,62; 08,97; 09,108; 10,92; 11,122; 12,118; 13,76; 15,86; 16,80; 17,76
RTECS Number	SD9470000
Formula Weight	172.57
Melting Point	92.0°C to 94.0°C
CAS Max %	30.0
Color	White
Physical Form	Moist Powder
SMILES	OOC(=O)C1=CC=CC(Cl)=C1
Merck Index	15,2154
Assay Percent Range	di-m-Chlorobenzoyl peroxide: < 0.1% Typical (HPLC)
CAS	7732-18-5
Health Hazard 3	GHS P Statement Wear protective gloves/protective clothing/eye protection/face protection. Keep away from heat/sparks/open flames/hot surfaces. - No smoking. Keep/Store away from clothing/ combustible materials. IF SWALLOWED: rin
MDL Number	MFCD00002127
Health Hazard 2	GHS H Statement Causes severe skin burns and eye damage. Harmful if swallowed. Heating may cause a fire.
Solubility Information	Solubility in water: insoluble. Other solubilities: soluble in koh, soluble in chloroform and acetone
Health Hazard 1	GHS Signal Word: Danger
Synonym	3-chloroperoxybenzoic acid,3-chloroperbenzoic acid,mcpba,m-chloroperbenzoic acid,m-chloroperoxybenzoic acid,meta-chloroperoxybenzoic acid,benzenecarboperoxoic acid, 3-chloro,m-chlorobenzoyl hydroperoxide,meta-chloroperbenzoic acid,3-chlorobenzoperoxoic acid
TSCA	TSCA
IUPAC Name	3-chlorobenzenecarboperoxoic acid
Beilstein	09,IV,972
Molecular Formula	C7H5ClO3
EINECS Number	213-322-3
Specific Gravity	0.56

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2-Nitrophenylhydrazine, 97%, moistened with ca 30% water

CAS: 3034-19-3 Molecular Formula: C₆H₇N₃O₂ Molecular Weight (g/mol): 153.14 MDL Number: MFCD00007577 InChI Key: FRBUNLLUASHNDJ-UHFFFAOYSA-N Synonym: 2-nitrophenyl hydrazine,hydrazine, nitrophenyl,hydrazine, o-nitrophenyl,o-nitrophenylhydrazine,hydrazine, 2-nitrophenyl,2-nitrophenylhrdrazine,2-nitrophenyl diazane,pubchem12859,acmc-1agti,o-nitrophenyl hydrazine PubChem CID: 3314739 IUPAC Name: (2-nitrophenyl)hydrazine SMILES: C1=CC=C(C(=C1)NN)[N+](=O)[O-]

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PubChem CID	3314739
CAS	3034-19-3
Molecular Weight (g/mol)	153.14
MDL Number	MFCD00007577
SMILES	C1=CC=C(C(=C1)NN)[N+](=O)[O-]
Synonym	2-nitrophenyl hydrazine,hydrazine, nitrophenyl,hydrazine, o-nitrophenyl,o-nitrophenylhydrazine,hydrazine, 2-nitrophenyl,2-nitrophenylhrdrazine,2-nitrophenyl diazane,pubchem12859,acmc-1agti,o-nitrophenyl hydrazine
IUPAC Name	(2-nitrophenyl)hydrazine
InChI Key	FRBUNLLUASHNDJ-UHFFFAOYSA-N
Molecular Formula	C₆H₇N₃O₂

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Benzoyl Peroxide (Wet/Certified),75%(weight), 25% water, Fisher Chemical™

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PubChem CID	7187
CAS	94-36-0
Molecular Weight (g/mol)	242.23
ChEBI	CHEBI:82405
MDL Number	MFCD00003071
SMILES	C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC=C2
Synonym	benzoyl peroxide,dibenzoyl peroxide,peroxide, dibenzoyl,benzoperoxide,benzoyl superoxide,acetoxyl,lucidol,benoxyl,panoxyl,benzol peroxide
IUPAC Name	benzoyl benzenecarboperoxoate
InChI Key	OMPJBNCRMGITSC-UHFFFAOYSA-N
Molecular Formula	C14H10O4

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(Formylmethylene)triphenylphosphorane, 97%, may cont. up to ca 3% water

CAS: 2136-75-6 Molecular Formula: C20H17OP Molecular Weight (g/mol): 304.329 MDL Number: MFCD00006994 InChI Key: CQCAYWAIRTVXIY-UHFFFAOYSA-N Synonym: 2-triphenylphosphoranylidene acetaldehyde,formylmethylene triphenylphosphorane,triphenylphosphoranylidene acetaldehyde,formylmethylenetriphenylphosphorane,acetaldehyde, triphenylphosphoranylidene,2-triphenyl-??-phosphanylidene acetaldehyde,acmc-209fjg,ksc492c5l PubChem CID: 75051 IUPAC Name: 2-(triphenyl-$l^{5}-phosphanylidene)acetaldehyde SMILES: C1=CC=C(C=C1)P(=CC=O)(C2=CC=CC=C2)C3=CC=CC=C3

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PubChem CID	75051
CAS	2136-75-6
Molecular Weight (g/mol)	304.329
MDL Number	MFCD00006994
SMILES	C1=CC=C(C=C1)P(=CC=O)(C2=CC=CC=C2)C3=CC=CC=C3
Synonym	2-triphenylphosphoranylidene acetaldehyde,formylmethylene triphenylphosphorane,triphenylphosphoranylidene acetaldehyde,formylmethylenetriphenylphosphorane,acetaldehyde, triphenylphosphoranylidene,2-triphenyl-??-phosphanylidene acetaldehyde,acmc-209fjg,ksc492c5l
IUPAC Name	2-(triphenyl-$l^{5}-phosphanylidene)acetaldehyde
InChI Key	CQCAYWAIRTVXIY-UHFFFAOYSA-N
Molecular Formula	C20H17OP

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(R)-(+)-2-Methyl-CBS-oxazaborolidine, 1M solution in toluene

CAS: 112022-83-0 Molecular Formula: C18H20BNO Molecular Weight (g/mol): 277.17 MDL Number: MFCD00078440 InChI Key: VMKAFJQFKBASMU-QGZVFWFLSA-N Synonym: r-2-methyl-cbs-oxazaborolidine,r-methyl oxazaborolidine,r-+-2-methyl-cbs-oxazaborolidine,r-5,5-diphenyl-2-methyl-3,4-propano-1,3,2-oxazaborolidine,r-1-methyl-3,3-diphenylhexahydropyrrolo 1,2-c 1,3,2 oxazaborole,r-me-cbs catalyst,r-3,3-diphenyl-1-methylpyrrolidino 1,2-c-1,3,2-oxazaborole,r-me cbs,r-tetrahydro-1-methyl-3,3-diphenyl-1h,3h-pyrrolo 1,2-c 1,3,2 oxazaborole,corey's catalyst PubChem CID: 9838490 IUPAC Name: (3aR)-1-methyl-3,3-diphenyl-3a,4,5,6-tetrahydropyrrolo[1,2-c][1,3,2]oxazaborole SMILES: [H][C@]12CCCN1B(C)OC2(C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	9838490
CAS	112022-83-0
Molecular Weight (g/mol)	277.17
MDL Number	MFCD00078440
SMILES	[H][C@]12CCCN1B(C)OC2(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	r-2-methyl-cbs-oxazaborolidine,r-methyl oxazaborolidine,r-+-2-methyl-cbs-oxazaborolidine,r-5,5-diphenyl-2-methyl-3,4-propano-1,3,2-oxazaborolidine,r-1-methyl-3,3-diphenylhexahydropyrrolo 1,2-c 1,3,2 oxazaborole,r-me-cbs catalyst,r-3,3-diphenyl-1-methylpyrrolidino 1,2-c-1,3,2-oxazaborole,r-me cbs,r-tetrahydro-1-methyl-3,3-diphenyl-1h,3h-pyrrolo 1,2-c 1,3,2 oxazaborole,corey's catalyst
IUPAC Name	(3aR)-1-methyl-3,3-diphenyl-3a,4,5,6-tetrahydropyrrolo[1,2-c][1,3,2]oxazaborole
InChI Key	VMKAFJQFKBASMU-QGZVFWFLSA-N
Molecular Formula	C18H20BNO

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2,4-Dinitroaniline, 99% (dry wt.), cont. up to 15% water

CAS: 97-02-9 Molecular Formula: C6H5N3O4 Molecular Weight (g/mol): 183.12 MDL Number: MFCD00007151 InChI Key: LXQOQPGNCGEELI-UHFFFAOYSA-N Synonym: benzenamine, 2,4-dinitro,1-amino-2,4-dinitrobenzene,2,4-dinitroanilin,2,4-dinitrobenzenamine,2,4-dinitroanilina,2,4-dinitraniline,2,4-dinitrophenylamine,aniline, 2,4-dinitro,2,4-dinitroaminobenzene,2,4-nitroaniline PubChem CID: 7321 ChEBI: CHEBI:34242 IUPAC Name: 2,4-dinitroaniline SMILES: NC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O

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PubChem CID	7321
CAS	97-02-9
Molecular Weight (g/mol)	183.12
ChEBI	CHEBI:34242
MDL Number	MFCD00007151
SMILES	NC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O
Synonym	benzenamine, 2,4-dinitro,1-amino-2,4-dinitrobenzene,2,4-dinitroanilin,2,4-dinitrobenzenamine,2,4-dinitroanilina,2,4-dinitraniline,2,4-dinitrophenylamine,aniline, 2,4-dinitro,2,4-dinitroaminobenzene,2,4-nitroaniline
IUPAC Name	2,4-dinitroaniline
InChI Key	LXQOQPGNCGEELI-UHFFFAOYSA-N
Molecular Formula	C6H5N3O4

Benzyltriethylammonium Hydroxide (10% in Water), TCI America™

CAS: 1836-42-6 Molecular Formula: C13H23NO Molecular Weight (g/mol): 209.333 MDL Number: MFCD00040488 InChI Key: FKPSBYZGRQJIMO-UHFFFAOYSA-M PubChem CID: 74601 IUPAC Name: benzyl(triethyl)azanium;hydroxide SMILES: CC[N+](CC)(CC)CC1=CC=CC=C1.[OH-]

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PubChem CID	74601
CAS	1836-42-6
Molecular Weight (g/mol)	209.333
MDL Number	MFCD00040488
SMILES	CC[N+](CC)(CC)CC1=CC=CC=C1.[OH-]
IUPAC Name	benzyl(triethyl)azanium;hydroxide
InChI Key	FKPSBYZGRQJIMO-UHFFFAOYSA-M
Molecular Formula	C13H23NO

4,4'-Diaminobiphenyl-2,2'-disulfonic acid hydrate, cont. up to 30% water

CAS: 117-61-3 Molecular Formula: C12H12N2O6S2 Molecular Weight (g/mol): 344.36 MDL Number: MFCD00041885 InChI Key: MBJAPGAZEWPEFB-UHFFFAOYSA-N Synonym: 2,2'-benzidinedisulfonic acid,2,2'-disulfobenzidine,benzidine-2,2'-disulfonic acid,6,6'-bimetanilic acid,4,4'-diaminobiphenyl-2,2'-disulfonic acid,benzidine-2,2'-disulphonic acid,4,4'-diamino-1,1'-biphenyl-2,2'-disulfonic acid,unii-alf643n2eq,benzidine, 2,2'-disulfo,4,4'-diamino-2,2'-biphenyldisulfonic acid PubChem CID: 8337 IUPAC Name: 5-amino-2-(4-amino-2-sulfophenyl)benzenesulfonic acid SMILES: NC1=CC=C(C2=CC=C(N)C=C2S(O)(=O)=O)C(=C1)S(O)(=O)=O

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Specifications

PubChem CID	8337
CAS	117-61-3
Molecular Weight (g/mol)	344.36
MDL Number	MFCD00041885
SMILES	NC1=CC=C(C2=CC=C(N)C=C2S(O)(=O)=O)C(=C1)S(O)(=O)=O
Synonym	2,2'-benzidinedisulfonic acid,2,2'-disulfobenzidine,benzidine-2,2'-disulfonic acid,6,6'-bimetanilic acid,4,4'-diaminobiphenyl-2,2'-disulfonic acid,benzidine-2,2'-disulphonic acid,4,4'-diamino-1,1'-biphenyl-2,2'-disulfonic acid,unii-alf643n2eq,benzidine, 2,2'-disulfo,4,4'-diamino-2,2'-biphenyldisulfonic acid
IUPAC Name	5-amino-2-(4-amino-2-sulfophenyl)benzenesulfonic acid
InChI Key	MBJAPGAZEWPEFB-UHFFFAOYSA-N
Molecular Formula	C12H12N2O6S2

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Sodium 3-nitrobenzoate, 94%, may contain up to ca 10% water

CAS: 827-95-2 Molecular Formula: C7H4NNaO4 Molecular Weight (g/mol): 189.10 MDL Number: MFCD00150535,MFCD00051097 InChI Key: MUADFEZFSKAZLT-UHFFFAOYSA-M Synonym: sodium 3-nitrobenzoate,3-nitrobenzoic acid sodium salt,benzoic acid, 3-nitro-, sodium salt,unii-i1eq837b3j,m-nitrobenzoic acid sodium salt,sodium m-nitrobenzoate,benzoic acid, 3-nitro-, sodium salt 1:1,3-nitrobenzoic acid, sodium salt,acmc-209pqe,dsstox_cid_24733 PubChem CID: 70014 IUPAC Name: sodium;3-nitrobenzoate SMILES: [Na+].[O-]C(=O)C1=CC=CC(=C1)[N+]([O-])=O

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Specifications

PubChem CID	70014
CAS	827-95-2
Molecular Weight (g/mol)	189.10
MDL Number	MFCD00150535,MFCD00051097
SMILES	[Na+].[O-]C(=O)C1=CC=CC(=C1)[N+]([O-])=O
Synonym	sodium 3-nitrobenzoate,3-nitrobenzoic acid sodium salt,benzoic acid, 3-nitro-, sodium salt,unii-i1eq837b3j,m-nitrobenzoic acid sodium salt,sodium m-nitrobenzoate,benzoic acid, 3-nitro-, sodium salt 1:1,3-nitrobenzoic acid, sodium salt,acmc-209pqe,dsstox_cid_24733
IUPAC Name	sodium;3-nitrobenzoate
InChI Key	MUADFEZFSKAZLT-UHFFFAOYSA-M
Molecular Formula	C7H4NNaO4

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4-Vinylphenol, 95%, 10% solution in propylene glycol, Thermo Scientific Chemicals

CAS: 2628-17-3 Molecular Formula: C₈H₈O Molecular Weight (g/mol): 120.16 InChI Key: FUGYGGDSWSUORM-UHFFFAOYSA-N Synonym: 4-vinylphenol,4-hydroxystyrene,p-vinylphenol,p-hydroxystyrene,phenol, 4-ethenyl,4-vinylphenol, 10 wt.% in propylene glycol,phenol, p-vinyl,unii-oa7v1sm8yl,fema no. 3739,poly 4-hydroxystyrene PubChem CID: 62453 ChEBI: CHEBI:1883 IUPAC Name: 4-ethenylphenol SMILES: C=CC1=CC=C(C=C1)O

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Specifications

PubChem CID	62453
CAS	2628-17-3
Molecular Weight (g/mol)	120.16
ChEBI	CHEBI:1883
SMILES	C=CC1=CC=C(C=C1)O
Synonym	4-vinylphenol,4-hydroxystyrene,p-vinylphenol,p-hydroxystyrene,phenol, 4-ethenyl,4-vinylphenol, 10 wt.% in propylene glycol,phenol, p-vinyl,unii-oa7v1sm8yl,fema no. 3739,poly 4-hydroxystyrene
IUPAC Name	4-ethenylphenol
InChI Key	FUGYGGDSWSUORM-UHFFFAOYSA-N
Molecular Formula	C₈H₈O

Benzyltrimethylammonium Hydroxide (10% in Water), TCI America™

CAS: 100-85-6 Molecular Formula: C10H17NO Molecular Weight (g/mol): 167.252 MDL Number: MFCD00008281 InChI Key: NDKBVBUGCNGSJJ-UHFFFAOYSA-M Synonym: benzyltrimethylammonium hydroxide,triton b,n,n,n-trimethyl-1-phenylmethanaminium hydroxide,trimethylbenzylammonium hydroxide,benzyl trimethylammonium hydroxide,benzyl trimethyl ammonium hydroxide,trimethyl benzylammonium hydroxide,sumquat 2311,benzyltrimetylammonium hydroxide,n,n,n-trimethylbenzenemethanaminium hydroxide PubChem CID: 66854 IUPAC Name: benzyl(trimethyl)azanium;hydroxide SMILES: C[N+](C)(C)CC1=CC=CC=C1.[OH-]

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PubChem CID	66854
CAS	100-85-6
Molecular Weight (g/mol)	167.252
MDL Number	MFCD00008281
SMILES	C[N+](C)(C)CC1=CC=CC=C1.[OH-]
Synonym	benzyltrimethylammonium hydroxide,triton b,n,n,n-trimethyl-1-phenylmethanaminium hydroxide,trimethylbenzylammonium hydroxide,benzyl trimethylammonium hydroxide,benzyl trimethyl ammonium hydroxide,trimethyl benzylammonium hydroxide,sumquat 2311,benzyltrimetylammonium hydroxide,n,n,n-trimethylbenzenemethanaminium hydroxide
IUPAC Name	benzyl(trimethyl)azanium;hydroxide
InChI Key	NDKBVBUGCNGSJJ-UHFFFAOYSA-M
Molecular Formula	C10H17NO

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Bis(triphenylphosphoranylidene)ammonium chloride, 97% (dry wt.), water <3%

CAS: 21050-13-5 Molecular Formula: C36H30ClNP2 Molecular Weight (g/mol): 574.04 MDL Number: MFCD00151523 InChI Key: LVRCYPYRKNAAMX-UHFFFAOYSA-M Synonym: 1,1,1-triphenyl-n-triphenylphosphoranylidene phosphoraniminium chloride,bis triphenylphosphoranylidene ammonium chloride,bis triphenylphosphoranylidene ammonium,triphenyl p,p,p-triphenylphosphine imidato-n phosphorus 1+ tetracarbonylcobaltate 1-,bis triphenylphosphine iminium chloride∼ppncl,ppn chloride,ppn cl,ksc491c1r,parent,triphenyl p,p,p-triphenylphosphine imidato phosphorus 1+ chloride PubChem CID: 3036656 IUPAC Name: triphenyl-[(triphenyl-$l^{5}-phosphanylidene)amino]phosphanium;chloride SMILES: [Cl-].C1=CC=C(C=C1)P(=[N+]=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	3036656
CAS	21050-13-5
Molecular Weight (g/mol)	574.04
MDL Number	MFCD00151523
SMILES	[Cl-].C1=CC=C(C=C1)P(=[N+]=P(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	1,1,1-triphenyl-n-triphenylphosphoranylidene phosphoraniminium chloride,bis triphenylphosphoranylidene ammonium chloride,bis triphenylphosphoranylidene ammonium,triphenyl p,p,p-triphenylphosphine imidato-n phosphorus 1+ tetracarbonylcobaltate 1-,bis triphenylphosphine iminium chloride∼ppncl,ppn chloride,ppn cl,ksc491c1r,parent,triphenyl p,p,p-triphenylphosphine imidato phosphorus 1+ chloride
IUPAC Name	triphenyl-[(triphenyl-$l^{5}-phosphanylidene)amino]phosphanium;chloride
InChI Key	LVRCYPYRKNAAMX-UHFFFAOYSA-M
Molecular Formula	C36H30ClNP2

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3-Amino-2,4,6-triiodobenzoic acid, 99% (dry wt.), water <4%

CAS: 3119-15-1 Molecular Formula: C7H3I3NNaO2 Molecular Weight (g/mol): 536.81 MDL Number: MFCD00007681 InChI Key: CTXRMWPLTDAHOR-UHFFFAOYSA-M Synonym: unii-99h77d8mtd,3-amino-2,4,6-triiodo-benzoic acid,acido 3-amino-2,4,6-triiodobenzoico italian,benzoic acid, 3-amino-2,4,6-triiodo,3-amino-2,4,6-triiodo-benzoicacid,acido 3-amino-2,4,6-triiodobenzoico,pubchem4987,acmc-1co9w,4-14-00-01118 beilstein handbook reference,2,4,6-triiodo-3-aminobenzoic acid PubChem CID: 18387 IUPAC Name: 3-amino-2,4,6-triiodobenzoic acid SMILES: [Na+].NC1=C(I)C=C(I)C(C([O-])=O)=C1I

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Specifications

PubChem CID	18387
CAS	3119-15-1
Molecular Weight (g/mol)	536.81
MDL Number	MFCD00007681
SMILES	[Na+].NC1=C(I)C=C(I)C(C([O-])=O)=C1I
Synonym	unii-99h77d8mtd,3-amino-2,4,6-triiodo-benzoic acid,acido 3-amino-2,4,6-triiodobenzoico italian,benzoic acid, 3-amino-2,4,6-triiodo,3-amino-2,4,6-triiodo-benzoicacid,acido 3-amino-2,4,6-triiodobenzoico,pubchem4987,acmc-1co9w,4-14-00-01118 beilstein handbook reference,2,4,6-triiodo-3-aminobenzoic acid
IUPAC Name	3-amino-2,4,6-triiodobenzoic acid
InChI Key	CTXRMWPLTDAHOR-UHFFFAOYSA-M
Molecular Formula	C7H3I3NNaO2

Benzene and substituted derivatives

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