Acetylides

Organic compounds that contain a carbon - carbon triple bond substituted with a metal in the following structure: MC≡CM, where C is carbon and M is a metal.

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1-Dodecyne, 97%, Thermo Scientific Chemicals

CAS: 765-03-7 Molecular Formula: C12H22 Molecular Weight (g/mol): 166.31 MDL Number: MFCD00008960 InChI Key: ZVDBUOGYYYNMQI-UHFFFAOYSA-N Synonym: 1-dodecyne,dodecyne,dodec-1-in,1dodecyne,dodec-1-yn,1-dodecyne 5g PubChem CID: 69821 IUPAC Name: dodec-1-yne SMILES: CCCCCCCCCCC#C

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PubChem CID	69821
CAS	765-03-7
Molecular Weight (g/mol)	166.31
MDL Number	MFCD00008960
SMILES	CCCCCCCCCCC#C
Synonym	1-dodecyne,dodecyne,dodec-1-in,1dodecyne,dodec-1-yn,1-dodecyne 5g
IUPAC Name	dodec-1-yne
InChI Key	ZVDBUOGYYYNMQI-UHFFFAOYSA-N
Molecular Formula	C12H22

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1-Boc-3-methylazetidine, 95%, Thermo Scientific Chemicals

CAS: 1314984-00-3 Molecular Formula: C10H15NO2 Molecular Weight (g/mol): 181.24 MDL Number: MFCD17016080 InChI Key: UENGYBYGCXKNRF-UHFFFAOYSA-N Synonym: 1-boc-3-ethynylazetidine,3-ethynyl-1-azetidinecarboxylic acid tert-butyl ester,1-boc-3-ethynyl-azetidine,tert-butyl3-ethynylazetidine-1-carboxylate,1-azetidinecarboxylic acid, 3-ethynyl-, 1,1-dimethylethyl ester PubChem CID: 54349237 IUPAC Name: tert-butyl 3-ethynylazetidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CC(C1)C#C

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PubChem CID	54349237
CAS	1314984-00-3
Molecular Weight (g/mol)	181.24
MDL Number	MFCD17016080
SMILES	CC(C)(C)OC(=O)N1CC(C1)C#C
Synonym	1-boc-3-ethynylazetidine,3-ethynyl-1-azetidinecarboxylic acid tert-butyl ester,1-boc-3-ethynyl-azetidine,tert-butyl3-ethynylazetidine-1-carboxylate,1-azetidinecarboxylic acid, 3-ethynyl-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl 3-ethynylazetidine-1-carboxylate
InChI Key	UENGYBYGCXKNRF-UHFFFAOYSA-N
Molecular Formula	C10H15NO2

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3-Butyn-1-ol, 98%

CAS: 927-74-2 Molecular Formula: C4H6O Molecular Weight (g/mol): 70.091 MDL Number: MFCD00002955 InChI Key: OTJZCIYGRUNXTP-UHFFFAOYSA-N Synonym: 3-butyn-1-ol,3-butynol,3-butyne-1-ol,4-hydroxy-1-butyne,3-butynyl alcohol,1-butyn-4-ol,2-hydroxyethylacetylene,homopropargyl alcohol,2-hydroxyethyl acetylene,4-hydroxy-butyne PubChem CID: 13566 ChEBI: CHEBI:27444 IUPAC Name: but-3-yn-1-ol SMILES: C#CCCO

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PubChem CID	13566
CAS	927-74-2
Molecular Weight (g/mol)	70.091
ChEBI	CHEBI:27444
MDL Number	MFCD00002955
SMILES	C#CCCO
Synonym	3-butyn-1-ol,3-butynol,3-butyne-1-ol,4-hydroxy-1-butyne,3-butynyl alcohol,1-butyn-4-ol,2-hydroxyethylacetylene,homopropargyl alcohol,2-hydroxyethyl acetylene,4-hydroxy-butyne
IUPAC Name	but-3-yn-1-ol
InChI Key	OTJZCIYGRUNXTP-UHFFFAOYSA-N
Molecular Formula	C4H6O

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Propargylamine, 99%

CAS: 2450-71-7 Molecular Formula: C₃H₅N Molecular Weight (g/mol): 55.08 MDL Number: MFCD00008198 InChI Key: JKANAVGODYYCQF-UHFFFAOYSA-N Synonym: propargylamine,2-propynylamine,2-propyn-1-amine,3-aminopropyne,3-amino-1-propyne,2-propyn-1-thiol,3-aminoprop-1-yne,propargylamin,pro-pargylamine,propargyl amine PubChem CID: 239041 IUPAC Name: prop-2-yn-1-amine SMILES: C#CCN

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PubChem CID	239041
CAS	2450-71-7
Molecular Weight (g/mol)	55.08
MDL Number	MFCD00008198
SMILES	C#CCN
Synonym	propargylamine,2-propynylamine,2-propyn-1-amine,3-aminopropyne,3-amino-1-propyne,2-propyn-1-thiol,3-aminoprop-1-yne,propargylamin,pro-pargylamine,propargyl amine
IUPAC Name	prop-2-yn-1-amine
InChI Key	JKANAVGODYYCQF-UHFFFAOYSA-N
Molecular Formula	C₃H₅N

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Propiolic acid, 98+%

CAS: 471-25-0 Molecular Formula: C3H2O2 Molecular Weight (g/mol): 70.05 MDL Number: MFCD00004360 InChI Key: UORVCLMRJXCDCP-UHFFFAOYSA-N Synonym: propiolic acid,2-propynoic acid,propynoic acid,propargylic acid,acetylenecarboxylic acid,carboxyacetylene,propiolic acidd,propiolicacid,unii-p2qw39g9lz,propynoate PubChem CID: 10110 ChEBI: CHEBI:33199 IUPAC Name: prop-2-ynoic acid SMILES: OC(=O)C#C

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PubChem CID	10110
CAS	471-25-0
Molecular Weight (g/mol)	70.05
ChEBI	CHEBI:33199
MDL Number	MFCD00004360
SMILES	OC(=O)C#C
Synonym	propiolic acid,2-propynoic acid,propynoic acid,propargylic acid,acetylenecarboxylic acid,carboxyacetylene,propiolic acidd,propiolicacid,unii-p2qw39g9lz,propynoate
IUPAC Name	prop-2-ynoic acid
InChI Key	UORVCLMRJXCDCP-UHFFFAOYSA-N
Molecular Formula	C3H2O2

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1-Heptyne, 99%

CAS: 628-71-7 Molecular Formula: C₇H₁₂ Molecular Weight (g/mol): 96.17 MDL Number: MFCD00009529 InChI Key: YVXHZKKCZYLQOP-UHFFFAOYSA-N Synonym: 1-heptyne,amylacetylene,heptyne,unii-z3nf9ssh6k,z3nf9ssh6k,amyl acetylene,n-pentylacetylene,pubchem13058,acmc-1aw2o PubChem CID: 12350 IUPAC Name: hept-1-yne SMILES: CCCCCC#C

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Specifications

PubChem CID	12350
CAS	628-71-7
Molecular Weight (g/mol)	96.17
MDL Number	MFCD00009529
SMILES	CCCCCC#C
Synonym	1-heptyne,amylacetylene,heptyne,unii-z3nf9ssh6k,z3nf9ssh6k,amyl acetylene,n-pentylacetylene,pubchem13058,acmc-1aw2o
IUPAC Name	hept-1-yne
InChI Key	YVXHZKKCZYLQOP-UHFFFAOYSA-N
Molecular Formula	C₇H₁₂

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Trimethylsilylacetylene, 98%

CAS: 1066-54-2 Molecular Formula: C5H10Si Molecular Weight (g/mol): 98.22 MDL Number: MFCD00008569 InChI Key: CWMFRHBXRUITQE-UHFFFAOYSA-N Synonym: trimethylsilylacetylene,trimethylsilyl acetylene,silane, ethynyltrimethyl,ethynyl-trimethyl-silane,ethynyl trimethyl silane,tms acetylene,ethynyltrimethyl silane,trimethylsilyl-acetylene,tmsacetylene PubChem CID: 66111 IUPAC Name: ethynyl(trimethyl)silane SMILES: C[Si](C)(C)C#C

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PubChem CID	66111
CAS	1066-54-2
Molecular Weight (g/mol)	98.22
MDL Number	MFCD00008569
SMILES	C[Si](C)(C)C#C
Synonym	trimethylsilylacetylene,trimethylsilyl acetylene,silane, ethynyltrimethyl,ethynyl-trimethyl-silane,ethynyl trimethyl silane,tms acetylene,ethynyltrimethyl silane,trimethylsilyl-acetylene,tmsacetylene
IUPAC Name	ethynyl(trimethyl)silane
InChI Key	CWMFRHBXRUITQE-UHFFFAOYSA-N
Molecular Formula	C5H10Si

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4-Ethynylaniline, 97%

CAS: 14235-81-5 Molecular Formula: C₈H₇N Molecular Weight (g/mol): 117.15 InChI Key: JXYITCJMBRETQX-UHFFFAOYSA-N Synonym: 4-aminophenylacetylene,4-ethynyl aniline,benzenamine, 4-ethynyl,p-aminophenylacetylene,1-amino-4-ethynylbenzene,4-aminophenyl acetylene,p-ethynylaniline,4-ethynylaniline,4-ethynyl-phenylamine,p-aminophenyl-acetylene PubChem CID: 3760025 IUPAC Name: 4-ethynylaniline SMILES: C#CC1=CC=C(C=C1)N

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PubChem CID	3760025
CAS	14235-81-5
Molecular Weight (g/mol)	117.15
SMILES	C#CC1=CC=C(C=C1)N
Synonym	4-aminophenylacetylene,4-ethynyl aniline,benzenamine, 4-ethynyl,p-aminophenylacetylene,1-amino-4-ethynylbenzene,4-aminophenyl acetylene,p-ethynylaniline,4-ethynylaniline,4-ethynyl-phenylamine,p-aminophenyl-acetylene
IUPAC Name	4-ethynylaniline
InChI Key	JXYITCJMBRETQX-UHFFFAOYSA-N
Molecular Formula	C₈H₇N

(R)-(-)-Deprenyl hydrochloride

CAS: 14611-52-0 Molecular Formula: C13H18ClN Molecular Weight (g/mol): 223.74 MDL Number: MFCD00069299 InChI Key: IYETZZCWLLUHIJ-UTONKHPSSA-N Synonym: selegiline hydrochloride,eldepryl,zelapar,selegiline hcl,l-deprenyl hydrochloride,jumex hydrochloride,--deprenyl hydrochloride,eldepryl hydrochloride,r-n-methyl-n-1-phenylpropan-2-yl prop-2-yn-1-amine hydrochloride,zydis selegiline PubChem CID: 26758 ChEBI: CHEBI:9087 IUPAC Name: hydrogen methyl[(2R)-1-phenylpropan-2-yl](prop-2-yn-1-yl)amine chloride SMILES: [H+].[Cl-].C[C@H](CC1=CC=CC=C1)N(C)CC#C

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PubChem CID	26758
CAS	14611-52-0
Molecular Weight (g/mol)	223.74
ChEBI	CHEBI:9087
MDL Number	MFCD00069299
SMILES	[H+].[Cl-].C[C@H](CC1=CC=CC=C1)N(C)CC#C
Synonym	selegiline hydrochloride,eldepryl,zelapar,selegiline hcl,l-deprenyl hydrochloride,jumex hydrochloride,--deprenyl hydrochloride,eldepryl hydrochloride,r-n-methyl-n-1-phenylpropan-2-yl prop-2-yn-1-amine hydrochloride,zydis selegiline
IUPAC Name	hydrogen methyl[(2R)-1-phenylpropan-2-yl](prop-2-yn-1-yl)amine chloride
InChI Key	IYETZZCWLLUHIJ-UTONKHPSSA-N
Molecular Formula	C13H18ClN

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5-Hexynenitrile, 98%

CAS: 14918-21-9 Molecular Formula: C6H7N Molecular Weight (g/mol): 93.129 MDL Number: MFCD00001978 InChI Key: JZYKFLLRVPPISG-UHFFFAOYSA-N Synonym: 5-hexynenitrile,5-cyano-1-pentyne,acmc-1c81n,5-hexynenitrile 1g PubChem CID: 139852 IUPAC Name: hex-5-ynenitrile SMILES: C#CCCCC#N

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PubChem CID	139852
CAS	14918-21-9
Molecular Weight (g/mol)	93.129
MDL Number	MFCD00001978
SMILES	C#CCCCC#N
Synonym	5-hexynenitrile,5-cyano-1-pentyne,acmc-1c81n,5-hexynenitrile 1g
IUPAC Name	hex-5-ynenitrile
InChI Key	JZYKFLLRVPPISG-UHFFFAOYSA-N
Molecular Formula	C6H7N

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3,3-Dimethyl-1-butyne, 98%

CAS: 917-92-0 Molecular Formula: C₆H₁₀ Molecular Weight (g/mol): 82.13 MDL Number: MFCD00008852 InChI Key: PPWNCLVNXGCGAF-UHFFFAOYSA-N Synonym: 3,3-dimethyl-1-butyne,tert-butylacetylene,t-butylacetylene,3,3-dimethylbutyne,1-butyne, 3,3-dimethyl,t-butyl acetylene,3,3,3-trimethylpropyne,1-butyne,3,3-dimethyl,tertbutylacetylene,tert-butylacetyiene PubChem CID: 13512 IUPAC Name: 3,3-dimethylbut-1-yne SMILES: CC(C)(C)C#C

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PubChem CID	13512
CAS	917-92-0
Molecular Weight (g/mol)	82.13
MDL Number	MFCD00008852
SMILES	CC(C)(C)C#C
Synonym	3,3-dimethyl-1-butyne,tert-butylacetylene,t-butylacetylene,3,3-dimethylbutyne,1-butyne, 3,3-dimethyl,t-butyl acetylene,3,3,3-trimethylpropyne,1-butyne,3,3-dimethyl,tertbutylacetylene,tert-butylacetyiene
IUPAC Name	3,3-dimethylbut-1-yne
InChI Key	PPWNCLVNXGCGAF-UHFFFAOYSA-N
Molecular Formula	C₆H₁₀

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3-Butyn-2-ol, 97%

CAS: 2028-63-9 Molecular Formula: C4H6O Molecular Weight (g/mol): 70.09 MDL Number: MFCD00004541 InChI Key: GKPOMITUDGXOSB-UHFFFAOYNA-N Synonym: 3-butyn-2-ol,3-butyne-2-ol,3-hydroxy-1-butyne,1-butyn-3-ol,1-methylpropargyl alcohol,methylethynylcarbinol,1-ethynylethanol,1-methyl-2-propynyl alcohol,alpha-methylpropargyl alcohol,dl-3-butyn-2-ol PubChem CID: 16239 IUPAC Name: but-3-yn-2-ol SMILES: CC(O)C#C

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PubChem CID	16239
CAS	2028-63-9
Molecular Weight (g/mol)	70.09
MDL Number	MFCD00004541
SMILES	CC(O)C#C
Synonym	3-butyn-2-ol,3-butyne-2-ol,3-hydroxy-1-butyne,1-butyn-3-ol,1-methylpropargyl alcohol,methylethynylcarbinol,1-ethynylethanol,1-methyl-2-propynyl alcohol,alpha-methylpropargyl alcohol,dl-3-butyn-2-ol
IUPAC Name	but-3-yn-2-ol
InChI Key	GKPOMITUDGXOSB-UHFFFAOYNA-N
Molecular Formula	C4H6O

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Propiolamide, 96%

CAS: 7341-96-0 Molecular Formula: C3H3NO Molecular Weight (g/mol): 69.06 MDL Number: MFCD04035573 InChI Key: HCJTYESURSHXNB-UHFFFAOYSA-N Synonym: propiolamide,2-propynamide,propynoic acid amide,propynamide,propiolic acid amide,propargylamide,hc.equiv.cconh2,propynoicacidamide,2-propynamide 9ci PubChem CID: 101445 ChEBI: CHEBI:51764 IUPAC Name: prop-2-ynamide SMILES: NC(=O)C#C

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PubChem CID	101445
CAS	7341-96-0
Molecular Weight (g/mol)	69.06
ChEBI	CHEBI:51764
MDL Number	MFCD04035573
SMILES	NC(=O)C#C
Synonym	propiolamide,2-propynamide,propynoic acid amide,propynamide,propiolic acid amide,propargylamide,hc.equiv.cconh2,propynoicacidamide,2-propynamide 9ci
IUPAC Name	prop-2-ynamide
InChI Key	HCJTYESURSHXNB-UHFFFAOYSA-N
Molecular Formula	C3H3NO

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Methyl 4-ethynylbenzoate, 97%

CAS: 3034-86-4 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.17 MDL Number: MFCD00168820 InChI Key: JPGRSTBIEYGVNO-UHFFFAOYSA-N Synonym: 4-ethynylbenzoic acid methyl ester,4-ethynyl-benzoic acid methyl ester,benzoic acid, 4-ethynyl-, methyl ester,methyl4-ethynylbenzoate,4-ethynylbenzoic acid methylester,4-methoxycarbonyl phenylacetylene,benzoic acid,4-ethynyl-, methyl ester,methyl 4-ethynyl-benzoate,4-ethinylbenzoic acid methyl ester,4-ethynyl benzoic acid methylester PubChem CID: 640163 IUPAC Name: methyl 4-ethynylbenzoate SMILES: COC(=O)C1=CC=C(C=C1)C#C

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PubChem CID	640163
CAS	3034-86-4
Molecular Weight (g/mol)	160.17
MDL Number	MFCD00168820
SMILES	COC(=O)C1=CC=C(C=C1)C#C
Synonym	4-ethynylbenzoic acid methyl ester,4-ethynyl-benzoic acid methyl ester,benzoic acid, 4-ethynyl-, methyl ester,methyl4-ethynylbenzoate,4-ethynylbenzoic acid methylester,4-methoxycarbonyl phenylacetylene,benzoic acid,4-ethynyl-, methyl ester,methyl 4-ethynyl-benzoate,4-ethinylbenzoic acid methyl ester,4-ethynyl benzoic acid methylester
IUPAC Name	methyl 4-ethynylbenzoate
InChI Key	JPGRSTBIEYGVNO-UHFFFAOYSA-N
Molecular Formula	C10H8O2

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4-Bromo-1-butyne, 97%

CAS: 38771-21-0 Molecular Formula: C4H5Br Molecular Weight (g/mol): 132.988 MDL Number: MFCD10000883 InChI Key: XLYOGWXIKVUXCL-UHFFFAOYSA-N Synonym: 4-bromo-1-butyne,1-bromo-3-butyne,1-butyne, 4-bromo,4-bromobutyne,3-butynyl bromide,1-bromo-3-butynol,4-bromo-but-1-yne,acmc-1afup,1-butyne, 4-bromo-6ci,9ci PubChem CID: 11073464 IUPAC Name: 4-bromobut-1-yne SMILES: C#CCCBr

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PubChem CID	11073464
CAS	38771-21-0
Molecular Weight (g/mol)	132.988
MDL Number	MFCD10000883
SMILES	C#CCCBr
Synonym	4-bromo-1-butyne,1-bromo-3-butyne,1-butyne, 4-bromo,4-bromobutyne,3-butynyl bromide,1-bromo-3-butynol,4-bromo-but-1-yne,acmc-1afup,1-butyne, 4-bromo-6ci,9ci
IUPAC Name	4-bromobut-1-yne
InChI Key	XLYOGWXIKVUXCL-UHFFFAOYSA-N
Molecular Formula	C4H5Br

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