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Nitrogen mustard compounds

Nitrogen mustards are cytotoxic organic compounds with the chloroethylamine functional group, which consists of the following structure: Cl(CH2)2NR2, where R can be any organic group. They are nitrogen analogs of mustard gas.
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1

Perfluorotributylamine, Mass Spec Std, Thermo Scientific Chemicals

CAS: 311-89-7 Molecular Formula: C12F27N Molecular Weight (g/mol): 671.096 MDL Number: MFCD00000436 InChI Key: RVZRBWKZFJCCIB-UHFFFAOYSA-N Synonym: perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine PubChem CID: 9397 ChEBI: CHEBI:38854 IUPAC Name: 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine SMILES: C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

PubChem CID 9397
CAS 311-89-7
Molecular Weight (g/mol) 671.096
ChEBI CHEBI:38854
MDL Number MFCD00000436
SMILES C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Synonym perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine
IUPAC Name 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine
InChI Key RVZRBWKZFJCCIB-UHFFFAOYSA-N
Molecular Formula C12F27N
2
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Perfluorotri-n-butylamine, tech. 90%, Thermo Scientific Chemicals

CAS: 311-89-7 Molecular Formula: C12F27N Molecular Weight (g/mol): 671.096 MDL Number: MFCD00000436 InChI Key: RVZRBWKZFJCCIB-UHFFFAOYSA-N Synonym: perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine PubChem CID: 9397 ChEBI: CHEBI:38854 IUPAC Name: 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine SMILES: C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

PubChem CID 9397
CAS 311-89-7
Molecular Weight (g/mol) 671.096
ChEBI CHEBI:38854
MDL Number MFCD00000436
SMILES C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Synonym perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine
IUPAC Name 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine
InChI Key RVZRBWKZFJCCIB-UHFFFAOYSA-N
Molecular Formula C12F27N
3
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Bis(2,2,2-trifluoroethyl)amine, 95%

CAS: 407-01-2 Molecular Formula: C4H5F6N Molecular Weight (g/mol): 181.081 MDL Number: MFCD00042094 InChI Key: GTJGHXLFPMOKCE-UHFFFAOYSA-N PubChem CID: 78999 IUPAC Name: 2,2,2-trifluoro-N-(2,2,2-trifluoroethyl)ethanamine SMILES: C(C(F)(F)F)NCC(F)(F)F

PubChem CID 78999
CAS 407-01-2
Molecular Weight (g/mol) 181.081
MDL Number MFCD00042094
SMILES C(C(F)(F)F)NCC(F)(F)F
IUPAC Name 2,2,2-trifluoro-N-(2,2,2-trifluoroethyl)ethanamine
InChI Key GTJGHXLFPMOKCE-UHFFFAOYSA-N
Molecular Formula C4H5F6N
5
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Bis(2-chloroethyl)amine hydrochloride, 98%

CAS: 821-48-7 Molecular Formula: C4H10Cl3N Molecular Weight (g/mol): 178.481 MDL Number: MFCD00012515 InChI Key: YMDZDFSUDFLGMX-UHFFFAOYSA-N Synonym: bis 2-chloroethyl amine hydrochloride,2,2'-dichlorodiethylamine hydrochloride,2-chloro-n-2-chloroethyl ethanamine hydrochloride,nor-lost hydrochlorid,nor-hn2,ethanamine, 2-chloro-n-2-chloroethyl-, hydrochloride,n,n-bis 2-chloroethyl amine hydrochloride,di-2-chloroethyl amine hydrochloride,2,2-dichlorodiethylamine hydrochloride,bis-2-chloroethyl amine hydrochloride PubChem CID: 522769 IUPAC Name: 2-chloro-N-(2-chloroethyl)ethanamine;hydrochloride SMILES: C(CCl)NCCCl.Cl

PubChem CID 522769
CAS 821-48-7
Molecular Weight (g/mol) 178.481
MDL Number MFCD00012515
SMILES C(CCl)NCCCl.Cl
Synonym bis 2-chloroethyl amine hydrochloride,2,2'-dichlorodiethylamine hydrochloride,2-chloro-n-2-chloroethyl ethanamine hydrochloride,nor-lost hydrochlorid,nor-hn2,ethanamine, 2-chloro-n-2-chloroethyl-, hydrochloride,n,n-bis 2-chloroethyl amine hydrochloride,di-2-chloroethyl amine hydrochloride,2,2-dichlorodiethylamine hydrochloride,bis-2-chloroethyl amine hydrochloride
IUPAC Name 2-chloro-N-(2-chloroethyl)ethanamine;hydrochloride
InChI Key YMDZDFSUDFLGMX-UHFFFAOYSA-N
Molecular Formula C4H10Cl3N
6
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Cyclophosphamide monohydrate, 97%

CAS: 6055-19-2 Molecular Formula: C7H17Cl2N2O3P Molecular Weight (g/mol): 279.10 MDL Number: MFCD00149395 InChI Key: PWOQRKCAHTVFLB-UHFFFAOYNA-N Synonym: cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated PubChem CID: 22420 ChEBI: CHEBI:4026 IUPAC Name: N,N-bis(2-chloroethyl)-2-oxo-1,3,2$l^{5}-oxazaphosphinan-2-amine;hydrate SMILES: O.ClCCN(CCCl)P1(=O)NCCCO1

PubChem CID 22420
CAS 6055-19-2
Molecular Weight (g/mol) 279.10
ChEBI CHEBI:4026
MDL Number MFCD00149395
SMILES O.ClCCN(CCCl)P1(=O)NCCCO1
Synonym cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated
IUPAC Name N,N-bis(2-chloroethyl)-2-oxo-1,3,2$l^{5}-oxazaphosphinan-2-amine;hydrate
InChI Key PWOQRKCAHTVFLB-UHFFFAOYNA-N
Molecular Formula C7H17Cl2N2O3P
7
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N,N-Bis(2-chloroethyl)-p-toluenesulfonamide, tech. 90%

CAS: 42137-88-2 Molecular Formula: C11H15Cl2NO2S Molecular Weight (g/mol): 296.206 MDL Number: MFCD00018944 InChI Key: PTVBBIMKLOMGSY-UHFFFAOYSA-N Synonym: n,n-bis 2-chloroethyl-p-toluenesulfonamide,n,n-bis 2-chloroethyl-4-methylbenzenesulfonamide,n,n-bis 2-chloroethyl-p-toluenesulphonamide,n,n-bis .beta.-chloroethyl-p-toluenesulfonamide,n,n-bis 2-chloroethyl-4-toluenesulfonamide,n,n-bis 2'-chloroethyl-4-methylbenzenesulfonamide,n,n-bis 2-chloroethyl-4-methylbenzene sulfonamide,n,n-bis 2-chloroethyl-4-methylbenzene sulphonamide,benzenesulfonamide, n,n-bis 2-chloroethyl-4-methyl,n,n-bis-2-chloro-ethyl-4-methyl-benzenesulfonamide PubChem CID: 96039 IUPAC Name: N,N-bis(2-chloroethyl)-4-methylbenzenesulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(CCCl)CCCl

PubChem CID 96039
CAS 42137-88-2
Molecular Weight (g/mol) 296.206
MDL Number MFCD00018944
SMILES CC1=CC=C(C=C1)S(=O)(=O)N(CCCl)CCCl
Synonym n,n-bis 2-chloroethyl-p-toluenesulfonamide,n,n-bis 2-chloroethyl-4-methylbenzenesulfonamide,n,n-bis 2-chloroethyl-p-toluenesulphonamide,n,n-bis .beta.-chloroethyl-p-toluenesulfonamide,n,n-bis 2-chloroethyl-4-toluenesulfonamide,n,n-bis 2'-chloroethyl-4-methylbenzenesulfonamide,n,n-bis 2-chloroethyl-4-methylbenzene sulfonamide,n,n-bis 2-chloroethyl-4-methylbenzene sulphonamide,benzenesulfonamide, n,n-bis 2-chloroethyl-4-methyl,n,n-bis-2-chloro-ethyl-4-methyl-benzenesulfonamide
IUPAC Name N,N-bis(2-chloroethyl)-4-methylbenzenesulfonamide
InChI Key PTVBBIMKLOMGSY-UHFFFAOYSA-N
Molecular Formula C11H15Cl2NO2S
8
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N-methyl-bis(trifluoroacetamide), 98%

CAS: 685-27-8 Molecular Formula: C5H3F6NO2 Molecular Weight (g/mol): 223.07 InChI Key: AWGBWLXGUPTXHF-UHFFFAOYSA-N Synonym: mbtfa,n-methyl-bis trifluoroacetamide,n-methylbis trifluoroacetamide,2,2,2-trifluoro-n-methyl-n-trifluoroacetyl acetamide,n,n-bis trifluoroacetyl methylamine,2,2,2-trifluoro-n-methyl-n-2,2,2-trifluoroacetyl acetamide,acetamide, 2,2,2-trifluoro-n-methyl-n-trifluoroacetyl,n-methylbistrifluoroacetamide,n-methyl-bis-trifluoroacetamide PubChem CID: 69635 IUPAC Name: 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide SMILES: CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F

PubChem CID 69635
CAS 685-27-8
Molecular Weight (g/mol) 223.07
SMILES CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F
Synonym mbtfa,n-methyl-bis trifluoroacetamide,n-methylbis trifluoroacetamide,2,2,2-trifluoro-n-methyl-n-trifluoroacetyl acetamide,n,n-bis trifluoroacetyl methylamine,2,2,2-trifluoro-n-methyl-n-2,2,2-trifluoroacetyl acetamide,acetamide, 2,2,2-trifluoro-n-methyl-n-trifluoroacetyl,n-methylbistrifluoroacetamide,n-methyl-bis-trifluoroacetamide
IUPAC Name 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide
InChI Key AWGBWLXGUPTXHF-UHFFFAOYSA-N
Molecular Formula C5H3F6NO2
9

eMolecules​ 50893-53-3 | 1-Chloroethyl chloroformate | Apollo Scientific US - Building Blocks | MFCD00000647 | 142.960 | C3H4Cl2O2 | 98.000 | CC(Cl)OC(Cl)=O | 500g | 448253967

1-Chloroethyl chloroformate | Apollo Scientific US - Building Blocks | 50893-53-3 | MFCD00000647 | 142.960 | C3H4Cl2O2 | 98.000 | CC(Cl)OC(Cl)=O | 500g | 448253967

ENCOMPASS_PREFERRED
10

eMolecules​ 50893-53-3 | 1-Chloroethyl chloroformate | Apollo Scientific US - Building Blocks | MFCD00000647 | 142.960 | C3H4Cl2O2 | 98.000 | CC(Cl)OC(Cl)=O | 25g | 398003359

1-Chloroethyl chloroformate | Apollo Scientific US - Building Blocks | 50893-53-3 | MFCD00000647 | 142.960 | C3H4Cl2O2 | 98.000 | CC(Cl)OC(Cl)=O | 25g | 398003359

ENCOMPASS_PREFERRED
11

eMolecules​ 50893-53-3 | 1-Chloroethyl chloroformate | Apollo Scientific US - Building Blocks | MFCD00000647 | 142.960 | C3H4Cl2O2 | 98.000 | CC(Cl)OC(Cl)=O | 100g | 398003360

1-Chloroethyl chloroformate | Apollo Scientific US - Building Blocks | 50893-53-3 | MFCD00000647 | 142.960 | C3H4Cl2O2 | 98.000 | CC(Cl)OC(Cl)=O | 100g | 398003360

ENCOMPASS_PREFERRED
12

eMolecules​ 1523618-10-1 | ChemScene | 4-(Cyclopropylsulfonimidoyl)aniline | 100mg | 761283903 | CS-0184344 | MFCD27987215 | 196.27 | C9H12N2OS

Medchem Express | -Lactamase-IN-2 | 5mg | 582658792 | HY-138247 | 2114651-20-4 | 208.188 | C11H9FO3

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13

eMolecules​ 19685-10-0 | Medchem Express | 10-Methoxycamptothecin | 5mg | 532150217 | HY-N0446 | MFCD11975376 | 378.384 | C21H18N2O5

Ambeed | (2S5S)-Hexane-25-diol | 250mg | 562292693 | A447376 | 34338-96-0 | MFCD00082583 | 118.176 | C6H14O2

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14

eMolecules​ 1122-96-9 | AstaTech | 4-METHOXYPYRIDINE 1-OXIDE | 5g | 233625492 | 34702 | 95 | MFCD00006207 | 125.127 | C6H7NO2

Medchem Express | Delta-Tocopherol | 50mg | 482204049 | HY-113026 | 119-13-1 | MFCD20486794 | 402.663 | C27H46O2

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15

eMolecules​ 213211-10-0 | Medchem Express | BIRT 377 | 5mg | 758391260 | HY-110117 | MFCD28166481 | 442.13 | C18H15BrCl2N2O2

Medchem Express | Isoorientin | 1mg | 446275345 | HY-N0767 | 4261-42-1 | MFCD00017433 | 448.380 | C21H20O11

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ENCOMPASS_PREFERRED