Chlorobenzene

Chlorobenzene is a toxic, flammable, volatile, aromatic, organic liquid with the chemical formula C6H5Cl. Available in a variety of quantities and purities, it is a common solvent and a widely used intermediate in the manufacture of other chemicals.

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Chlorobenzene (Laboratory), Fisher Chemical™

CAS: 108-90-7 Molecular Formula: C6H5Cl Molecular Weight (g/mol): 112.556 MDL Number: MFCD00000530 InChI Key: MVPPADPHJFYWMZ-UHFFFAOYSA-N Synonym: monochlorobenzene,benzene chloride,phenyl chloride,benzene, chloro,chlorbenzene,chlorobenzol,monochlorbenzol,chlorbenzol,chlorobenzen,clorobenzene PubChem CID: 7964 ChEBI: CHEBI:28097 IUPAC Name: chlorobenzene SMILES: C1=CC=C(C=C1)Cl

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Specifications

PubChem CID	7964
CAS	108-90-7
Molecular Weight (g/mol)	112.556
ChEBI	CHEBI:28097
MDL Number	MFCD00000530
SMILES	C1=CC=C(C=C1)Cl
Synonym	monochlorobenzene,benzene chloride,phenyl chloride,benzene, chloro,chlorbenzene,chlorobenzol,monochlorbenzol,chlorbenzol,chlorobenzen,clorobenzene
IUPAC Name	chlorobenzene
InChI Key	MVPPADPHJFYWMZ-UHFFFAOYSA-N
Molecular Formula	C6H5Cl

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1,2,4-Trichlorobenzene (HPLC), Fisher Chemical

CAS: 120-82-1 Molecular Formula: C6H3Cl3 Molecular Weight (g/mol): 181.44 MDL Number: MFCD00000547 InChI Key: PBKONEOXTCPAFI-UHFFFAOYSA-N Synonym: benzene, 1,2,4-trichloro,unsym-trichlorobenzene,hostetex l-pec,trojchlorobenzen,1,2,4-trichlorbenzol,1,2,4-trichlorobenzol,1,3,4-trichlorobenzene,trichlorobenzene a,1,2,5-trichlorobenzene,as-trichlorobenzene PubChem CID: 13 ChEBI: CHEBI:28222 IUPAC Name: 1,2,4-trichlorobenzene SMILES: C1=CC(=C(C=C1Cl)Cl)Cl

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Specifications

PubChem CID	13
CAS	120-82-1
Molecular Weight (g/mol)	181.44
ChEBI	CHEBI:28222
MDL Number	MFCD00000547
SMILES	C1=CC(=C(C=C1Cl)Cl)Cl
Synonym	benzene, 1,2,4-trichloro,unsym-trichlorobenzene,hostetex l-pec,trojchlorobenzen,1,2,4-trichlorbenzol,1,2,4-trichlorobenzol,1,3,4-trichlorobenzene,trichlorobenzene a,1,2,5-trichlorobenzene,as-trichlorobenzene
IUPAC Name	1,2,4-trichlorobenzene
InChI Key	PBKONEOXTCPAFI-UHFFFAOYSA-N
Molecular Formula	C6H3Cl3

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(R)-1-(4-Chlorophenyl)ethylamine, 97%, 98% ee

CAS: 27298-99-3 Molecular Formula: C₈H₁₀ClN Molecular Weight (g/mol): 155.63 MDL Number: MFCD00671639 InChI Key: PINPOEWMCLFRRB-ZCFIWIBFSA-N Synonym: r-1-4-chlorophenyl ethylamine,r-1-4-chlorophenyl ethanamine,1r-1-4-chlorophenyl ethanamine,r-+-1-4-chlorophenyl ethylamine,1r-1-4-chlorophenyl ethan-1-amine,benzenemethanamine, 4-chloro-alpha-methyl-, alphar,pubchem15222,r-4-chloro-,a-methylbenzylamine,1r-1-4-chlorophenyl ethylamine,r-1-4-chloro-phenyl ethylamine PubChem CID: 1715226 IUPAC Name: (1R)-1-(4-chlorophenyl)ethanamine SMILES: CC(C1=CC=C(C=C1)Cl)N

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Specifications

PubChem CID	1715226
CAS	27298-99-3
Molecular Weight (g/mol)	155.63
MDL Number	MFCD00671639
SMILES	CC(C1=CC=C(C=C1)Cl)N
Synonym	r-1-4-chlorophenyl ethylamine,r-1-4-chlorophenyl ethanamine,1r-1-4-chlorophenyl ethanamine,r-+-1-4-chlorophenyl ethylamine,1r-1-4-chlorophenyl ethan-1-amine,benzenemethanamine, 4-chloro-alpha-methyl-, alphar,pubchem15222,r-4-chloro-,a-methylbenzylamine,1r-1-4-chlorophenyl ethylamine,r-1-4-chloro-phenyl ethylamine
IUPAC Name	(1R)-1-(4-chlorophenyl)ethanamine
InChI Key	PINPOEWMCLFRRB-ZCFIWIBFSA-N
Molecular Formula	C₈H₁₀ClN

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Bis(4-chlorophenyl) disulfide, 98+%

CAS: 1142-19-4 Molecular Formula: C12H8Cl2S2 Molecular Weight (g/mol): 287.216 MDL Number: MFCD00013642 InChI Key: ZIXXRXGPBFMPFD-UHFFFAOYSA-N Synonym: 4,4'-dichlorodiphenyl disulfide,bis 4-chlorophenyl disulfide,disulfide, bis 4-chlorophenyl,ddds,ddds pesticide,disulfide, bis p-chlorophenyl,p-chlorophenyl disulfide,4-chlorophenyl disulfide,bis p-chlorophenyl disulfide,4,4'-dichloro diphenyl disulfide PubChem CID: 14360 IUPAC Name: 1-chloro-4-[(4-chlorophenyl)disulfanyl]benzene SMILES: C1=CC(=CC=C1SSC2=CC=C(C=C2)Cl)Cl

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Specifications

PubChem CID	14360
CAS	1142-19-4
Molecular Weight (g/mol)	287.216
MDL Number	MFCD00013642
SMILES	C1=CC(=CC=C1SSC2=CC=C(C=C2)Cl)Cl
Synonym	4,4'-dichlorodiphenyl disulfide,bis 4-chlorophenyl disulfide,disulfide, bis 4-chlorophenyl,ddds,ddds pesticide,disulfide, bis p-chlorophenyl,p-chlorophenyl disulfide,4-chlorophenyl disulfide,bis p-chlorophenyl disulfide,4,4'-dichloro diphenyl disulfide
IUPAC Name	1-chloro-4-[(4-chlorophenyl)disulfanyl]benzene
InChI Key	ZIXXRXGPBFMPFD-UHFFFAOYSA-N
Molecular Formula	C12H8Cl2S2

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4-Chlorophenylacetylene, 98%

CAS: 873-73-4 Molecular Formula: C8H5Cl Molecular Weight (g/mol): 136.578 MDL Number: MFCD00191917 InChI Key: LFZJRTMTKGYJRS-UHFFFAOYSA-N Synonym: 4-chlorophenylacetylene,benzene, 1-chloro-4-ethynyl,4'-chlorophenyl acetylene,4-chlorophenyl acetylene,1-chloro-4-ethynyl-benzene,p-ethynylchlorobenzene,p-chlorophenylacetylene,p-chlorophenyl acetylene,1-chlor-4-ethinylbenzol,4-chlorophenylethyne PubChem CID: 70118 IUPAC Name: 1-chloro-4-ethynylbenzene SMILES: C#CC1=CC=C(C=C1)Cl

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Specifications

PubChem CID	70118
CAS	873-73-4
Molecular Weight (g/mol)	136.578
MDL Number	MFCD00191917
SMILES	C#CC1=CC=C(C=C1)Cl
Synonym	4-chlorophenylacetylene,benzene, 1-chloro-4-ethynyl,4'-chlorophenyl acetylene,4-chlorophenyl acetylene,1-chloro-4-ethynyl-benzene,p-ethynylchlorobenzene,p-chlorophenylacetylene,p-chlorophenyl acetylene,1-chlor-4-ethinylbenzol,4-chlorophenylethyne
IUPAC Name	1-chloro-4-ethynylbenzene
InChI Key	LFZJRTMTKGYJRS-UHFFFAOYSA-N
Molecular Formula	C8H5Cl

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2-chlorophenylacetyl Chloride, 97%

CAS: 51512-09-5 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.04 MDL Number: MFCD00130223 InChI Key: WIHSAOYVGKVRJX-UHFFFAOYSA-N Synonym: 2-chlorophenylacetyl chloride,2-2-chlorophenyl acetyl chloride,acetyl chloride, 2-2-chlorophenyl,o-chlorophenylacetyl chloride,benzeneacetyl chloride, 2-chloro,2-chlorophenylacetyl chloride stabilized with copper chip,acmc-1auqq,o-chlor-phenylacetylchlorid,o-chloro-phenylacetyl chloride,2-chloro-phenylacetyl chloride PubChem CID: 182669 IUPAC Name: 2-(2-chlorophenyl)acetyl chloride SMILES: ClC(=O)CC1=CC=CC=C1Cl

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Specifications

PubChem CID	182669
CAS	51512-09-5
Molecular Weight (g/mol)	189.04
MDL Number	MFCD00130223
SMILES	ClC(=O)CC1=CC=CC=C1Cl
Synonym	2-chlorophenylacetyl chloride,2-2-chlorophenyl acetyl chloride,acetyl chloride, 2-2-chlorophenyl,o-chlorophenylacetyl chloride,benzeneacetyl chloride, 2-chloro,2-chlorophenylacetyl chloride stabilized with copper chip,acmc-1auqq,o-chlor-phenylacetylchlorid,o-chloro-phenylacetyl chloride,2-chloro-phenylacetyl chloride
IUPAC Name	2-(2-chlorophenyl)acetyl chloride
InChI Key	WIHSAOYVGKVRJX-UHFFFAOYSA-N
Molecular Formula	C8H6Cl2O

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(S)-(-)-1-(4-Chlorophenyl)ethylamine, ChiPros™ 94%

CAS: 4187-56-8 Molecular Formula: C8H10ClN Molecular Weight (g/mol): 155.625 MDL Number: MFCD00671640 InChI Key: PINPOEWMCLFRRB-LURJTMIESA-N Synonym: s-1-4-chlorophenyl ethylamine,s-1-4-chlorophenyl ethanamine,1s-1-4-chlorophenyl ethanamine,s-4-chloro-alpha-methylbenzylamine,s---1-4-chlorophenyl ethylamine,1s-1-4-chlorophenyl ethan-1-amine,pubchem15221,s-4-chloro-,a-methylbenzylamine,1s-1-4-chlorophenyl ethylamine,s-1-4-chloro-phenyl ethylamine PubChem CID: 1550852 IUPAC Name: (1S)-1-(4-chlorophenyl)ethanamine SMILES: CC(C1=CC=C(C=C1)Cl)N

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Specifications

PubChem CID	1550852
CAS	4187-56-8
Molecular Weight (g/mol)	155.625
MDL Number	MFCD00671640
SMILES	CC(C1=CC=C(C=C1)Cl)N
Synonym	s-1-4-chlorophenyl ethylamine,s-1-4-chlorophenyl ethanamine,1s-1-4-chlorophenyl ethanamine,s-4-chloro-alpha-methylbenzylamine,s---1-4-chlorophenyl ethylamine,1s-1-4-chlorophenyl ethan-1-amine,pubchem15221,s-4-chloro-,a-methylbenzylamine,1s-1-4-chlorophenyl ethylamine,s-1-4-chloro-phenyl ethylamine
IUPAC Name	(1S)-1-(4-chlorophenyl)ethanamine
InChI Key	PINPOEWMCLFRRB-LURJTMIESA-N
Molecular Formula	C8H10ClN

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alpha-Bromo-4-chlorophenylacetic acid, 97%

CAS: 3381-73-5 Molecular Formula: C8H6BrClO2 Molecular Weight (g/mol): 249.49 MDL Number: MFCD08276760 InChI Key: KKOAAWLOOHBFQP-UHFFFAOYNA-N Synonym: 2-bromo-2-4-chlorophenyl acetic acid,alpha-bromo-4-chlorophenylacetic acid,bromo 4-chlorophenyl acetic acid,acmc-1ct0u,bromo-4-chlorophenyl acetic acid,bromo-4-chloro-phenyl acetic acid,bromo-4-chloro-phenyl-acetic acid,2-bromo-2-4-chlorophenyl aceticacid,alpha-bromo-p-chloro phenylacetic acid,alpha-bromo-p-chlorophenyl acetic acid PubChem CID: 10490868 IUPAC Name: 2-bromo-2-(4-chlorophenyl)acetic acid SMILES: OC(=O)C(Br)C1=CC=C(Cl)C=C1

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Specifications

PubChem CID	10490868
CAS	3381-73-5
Molecular Weight (g/mol)	249.49
MDL Number	MFCD08276760
SMILES	OC(=O)C(Br)C1=CC=C(Cl)C=C1
Synonym	2-bromo-2-4-chlorophenyl acetic acid,alpha-bromo-4-chlorophenylacetic acid,bromo 4-chlorophenyl acetic acid,acmc-1ct0u,bromo-4-chlorophenyl acetic acid,bromo-4-chloro-phenyl acetic acid,bromo-4-chloro-phenyl-acetic acid,2-bromo-2-4-chlorophenyl aceticacid,alpha-bromo-p-chloro phenylacetic acid,alpha-bromo-p-chlorophenyl acetic acid
IUPAC Name	2-bromo-2-(4-chlorophenyl)acetic acid
InChI Key	KKOAAWLOOHBFQP-UHFFFAOYNA-N
Molecular Formula	C8H6BrClO2

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2-Chlorophenylboronic acid, 97%

CAS: 3900-89-8 Molecular Formula: C6H6BClO2 Molecular Weight (g/mol): 156.37 MDL Number: MFCD00674012 InChI Key: RRCMGJCFMJBHQC-UHFFFAOYSA-N Synonym: 2-chlorophenyl boronic acid,2-chlorobenzeneboronic acid,2-chlorophenylboronicacid,2-chlorophenylbornic acid,o-chlorophenylboronic acid,2-chlorophenyl boranediol,boronic acid, 2-chlorophenyl,2-chloro-phenyl-boronic acid,boronic acid, b-2-chlorophenyl PubChem CID: 2734322 IUPAC Name: (2-chlorophenyl)boronic acid SMILES: OB(O)C1=CC=CC=C1Cl

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Specifications

PubChem CID	2734322
CAS	3900-89-8
Molecular Weight (g/mol)	156.37
MDL Number	MFCD00674012
SMILES	OB(O)C1=CC=CC=C1Cl
Synonym	2-chlorophenyl boronic acid,2-chlorobenzeneboronic acid,2-chlorophenylboronicacid,2-chlorophenylbornic acid,o-chlorophenylboronic acid,2-chlorophenyl boranediol,boronic acid, 2-chlorophenyl,2-chloro-phenyl-boronic acid,boronic acid, b-2-chlorophenyl
IUPAC Name	(2-chlorophenyl)boronic acid
InChI Key	RRCMGJCFMJBHQC-UHFFFAOYSA-N
Molecular Formula	C6H6BClO2

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1,3-Dibromo-5-chlorobenzene, 98%, Thermo Scientific Chemicals

CAS: 14862-52-3 Molecular Formula: C6H3Br2Cl Molecular Weight (g/mol): 270.348 MDL Number: MFCD00070765 InChI Key: FNKCOUREFBNNHG-UHFFFAOYSA-N Synonym: 3,5-dibromochlorobenzene,1-chloro-3,5-dibromobenzene,benzene, 1,3-dibromo-5-chloro,pubchem3634,ambsclk-224,intermediates-zcf02139,ksc181m3d,1,3-dibromo-5-chloro-benzene,tpc-i027,fnkcourefbnnhg-uhfffaoysa PubChem CID: 84676 IUPAC Name: 1,3-dibromo-5-chlorobenzene SMILES: C1=C(C=C(C=C1Br)Br)Cl

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Specifications

PubChem CID	84676
CAS	14862-52-3
Molecular Weight (g/mol)	270.348
MDL Number	MFCD00070765
SMILES	C1=C(C=C(C=C1Br)Br)Cl
Synonym	3,5-dibromochlorobenzene,1-chloro-3,5-dibromobenzene,benzene, 1,3-dibromo-5-chloro,pubchem3634,ambsclk-224,intermediates-zcf02139,ksc181m3d,1,3-dibromo-5-chloro-benzene,tpc-i027,fnkcourefbnnhg-uhfffaoysa
IUPAC Name	1,3-dibromo-5-chlorobenzene
InChI Key	FNKCOUREFBNNHG-UHFFFAOYSA-N
Molecular Formula	C6H3Br2Cl

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1-(4-Chlorophenyl)-1-cyclopentanecarboxylic acid, 98%, Thermo Scientific™

CAS: 80789-69-1 Molecular Formula: C₁₂H₁₃ClO₂ Molecular Weight (g/mol): 224.69 MDL Number: MFCD00001373 InChI Key: QJNFJEMGWIQMJT-UHFFFAOYSA-N Synonym: 1-4-chlorophenyl cyclopentanecarboxylic acid,1-4-chlorophenyl-1-cyclopentanecarboxylic acid,1-4-chlorophenyl cyclopentane-1-carboxylic acid,cyclopentanecarboxylic acid, 1-4-chlorophenyl,asischem d50961,timtec-bb sbb000649,acmc-209pk2,labotest-bb lt00453384,1-4-chloro phenyl cyclopentanecarboxylic acid,1-4-chloro-phenyl-cyclopentylcarboxylic acid PubChem CID: 97447 IUPAC Name: 1-(4-chlorophenyl)cyclopentane-1-carboxylic acid SMILES: C1CCC(C1)(C2=CC=C(C=C2)Cl)C(=O)O

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Specifications

PubChem CID	97447
CAS	80789-69-1
Molecular Weight (g/mol)	224.69
MDL Number	MFCD00001373
SMILES	C1CCC(C1)(C2=CC=C(C=C2)Cl)C(=O)O
Synonym	1-4-chlorophenyl cyclopentanecarboxylic acid,1-4-chlorophenyl-1-cyclopentanecarboxylic acid,1-4-chlorophenyl cyclopentane-1-carboxylic acid,cyclopentanecarboxylic acid, 1-4-chlorophenyl,asischem d50961,timtec-bb sbb000649,acmc-209pk2,labotest-bb lt00453384,1-4-chloro phenyl cyclopentanecarboxylic acid,1-4-chloro-phenyl-cyclopentylcarboxylic acid
IUPAC Name	1-(4-chlorophenyl)cyclopentane-1-carboxylic acid
InChI Key	QJNFJEMGWIQMJT-UHFFFAOYSA-N
Molecular Formula	C₁₂H₁₃ClO₂

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Diethyl 4-chlorobenzylphosphonate, 98+%

CAS: 39225-17-7 Molecular Formula: C11H16ClO3P Molecular Weight (g/mol): 262.67 MDL Number: MFCD00051568 InChI Key: BVQPVBZRJSFOEZ-UHFFFAOYSA-N Synonym: diethyl 4-chlorobenzylphosphonate,diethyl 4-chlorobenzyl phosphonate,diethyl 4-chlorophenyl methylphosphonate,1-chloro-4-diethoxyphosphorylmethyl benzene,phosphonic acid, 4-chlorophenyl methyl-, diethyl ester,phosphonic acid, p-4-chlorophenyl methyl-, diethyl ester,acmc-1aifv,diethyl 4-chlorobenzylposphonate,diethyl 4-chlorobenzylphosphate PubChem CID: 99240 IUPAC Name: 1-chloro-4-(diethoxyphosphorylmethyl)benzene SMILES: CCOP(=O)(CC1=CC=C(C=C1)Cl)OCC

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Specifications

PubChem CID	99240
CAS	39225-17-7
Molecular Weight (g/mol)	262.67
MDL Number	MFCD00051568
SMILES	CCOP(=O)(CC1=CC=C(C=C1)Cl)OCC
Synonym	diethyl 4-chlorobenzylphosphonate,diethyl 4-chlorobenzyl phosphonate,diethyl 4-chlorophenyl methylphosphonate,1-chloro-4-diethoxyphosphorylmethyl benzene,phosphonic acid, 4-chlorophenyl methyl-, diethyl ester,phosphonic acid, p-4-chlorophenyl methyl-, diethyl ester,acmc-1aifv,diethyl 4-chlorobenzylposphonate,diethyl 4-chlorobenzylphosphate
IUPAC Name	1-chloro-4-(diethoxyphosphorylmethyl)benzene
InChI Key	BVQPVBZRJSFOEZ-UHFFFAOYSA-N
Molecular Formula	C11H16ClO3P

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3-Chloro-4-methylphenylmagnesium bromide, 0.50 M in 2-MeTHF

CAS: 515158-85-7 Molecular Formula: C7H6BrClMg Molecular Weight (g/mol): 229.78 MDL Number: MFCD11553191 InChI Key: MYJXIKNUSSYMAS-UHFFFAOYSA-M Synonym: 3-chloro-4-methylphenylmagnesium bromide,magnesium, bromo 3-chloro-4-methylphenyl,3-chloro-4-methylphenylmagnesium bromide, 0.50 m in 2-methf,grignard reagent PubChem CID: 24807894 IUPAC Name: magnesium;1-chloro-2-methylbenzene-5-ide;bromide SMILES: CC1=CC=C([Mg]Br)C=C1Cl

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Specifications

PubChem CID	24807894
CAS	515158-85-7
Molecular Weight (g/mol)	229.78
MDL Number	MFCD11553191
SMILES	CC1=CC=C([Mg]Br)C=C1Cl
Synonym	3-chloro-4-methylphenylmagnesium bromide,magnesium, bromo 3-chloro-4-methylphenyl,3-chloro-4-methylphenylmagnesium bromide, 0.50 m in 2-methf,grignard reagent
IUPAC Name	magnesium;1-chloro-2-methylbenzene-5-ide;bromide
InChI Key	MYJXIKNUSSYMAS-UHFFFAOYSA-M
Molecular Formula	C7H6BrClMg

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3-Chloro-2-fluoroaniline, 97%

CAS: 2106-04-9 MDL Number: MFCD00069415

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Specifications

CAS	2106-04-9
MDL Number	MFCD00069415

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1-Chloro-4-ethynylbenzene, 98%

CAS: 873-73-4 Molecular Formula: C₈H₅Cl Molecular Weight (g/mol): 136.58 MDL Number: MFCD00191917 InChI Key: LFZJRTMTKGYJRS-UHFFFAOYSA-N Synonym: 4-chlorophenylacetylene,benzene, 1-chloro-4-ethynyl,4'-chlorophenyl acetylene,4-chlorophenyl acetylene,1-chloro-4-ethynyl-benzene,p-ethynylchlorobenzene,p-chlorophenylacetylene,p-chlorophenyl acetylene,1-chlor-4-ethinylbenzol,4-chlorophenylethyne PubChem CID: 70118 IUPAC Name: 1-chloro-4-ethynylbenzene SMILES: C#CC1=CC=C(C=C1)Cl

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Specifications

PubChem CID	70118
CAS	873-73-4
Molecular Weight (g/mol)	136.58
MDL Number	MFCD00191917
SMILES	C#CC1=CC=C(C=C1)Cl
Synonym	4-chlorophenylacetylene,benzene, 1-chloro-4-ethynyl,4'-chlorophenyl acetylene,4-chlorophenyl acetylene,1-chloro-4-ethynyl-benzene,p-ethynylchlorobenzene,p-chlorophenylacetylene,p-chlorophenyl acetylene,1-chlor-4-ethinylbenzol,4-chlorophenylethyne
IUPAC Name	1-chloro-4-ethynylbenzene
InChI Key	LFZJRTMTKGYJRS-UHFFFAOYSA-N
Molecular Formula	C₈H₅Cl

Chlorobenzene

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