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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trans-4-(4-Chlorophenyl)cyclohexane-1-carboxylic acid, 98%

CAS: 49708-81-8 Molecular Formula: C13H15ClO2 Molecular Weight (g/mol): 238.711 MDL Number: MFCD06797626 InChI Key: NXXDIEYTMQYWJU-UHFFFAOYSA-N Synonym: 4-4-chlorophenyl cyclohexanecarboxylic acid,trans-4-4-chlorophenyl cyclohexanecarboxylic acid,4-4-chlorophenyl cyclohexane-1-carboxylic acid,e-4-4-chlorophenyl cyclohexanecarboxylic acid,4-4'-chlorophenyl cyclohexancarboxylic acid,cis-4-4-chlorophenyl cyclohexanecarboxylic acid,atovaquone related compound 1,cyclohexanecarboxylic acid, 4-4-chlorophenyl-, trans,1r,4r-4-4-chlorophenyl cyclohexane-1-carboxylic acid,cyclohexanecarboxylic acid, 4-4-chlorophenyl PubChem CID: 2735792 IUPAC Name: 4-(4-chlorophenyl)cyclohexane-1-carboxylic acid SMILES: C1CC(CCC1C2=CC=C(C=C2)Cl)C(=O)O

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Specifications

PubChem CID	2735792
CAS	49708-81-8
Molecular Weight (g/mol)	238.711
MDL Number	MFCD06797626
SMILES	C1CC(CCC1C2=CC=C(C=C2)Cl)C(=O)O
Synonym	4-4-chlorophenyl cyclohexanecarboxylic acid,trans-4-4-chlorophenyl cyclohexanecarboxylic acid,4-4-chlorophenyl cyclohexane-1-carboxylic acid,e-4-4-chlorophenyl cyclohexanecarboxylic acid,4-4'-chlorophenyl cyclohexancarboxylic acid,cis-4-4-chlorophenyl cyclohexanecarboxylic acid,atovaquone related compound 1,cyclohexanecarboxylic acid, 4-4-chlorophenyl-, trans,1r,4r-4-4-chlorophenyl cyclohexane-1-carboxylic acid,cyclohexanecarboxylic acid, 4-4-chlorophenyl
IUPAC Name	4-(4-chlorophenyl)cyclohexane-1-carboxylic acid
InChI Key	NXXDIEYTMQYWJU-UHFFFAOYSA-N
Molecular Formula	C13H15ClO2

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4-Chlorophenethyl bromide, 95%

CAS: 6529-53-9 Molecular Formula: C₈H₈BrCl Molecular Weight (g/mol): 219.51 InChI Key: YAFMYKFAUNCQPU-UHFFFAOYSA-N Synonym: 1-2-bromoethyl-4-chlorobenzene,4-chlorophenethyl bromide,2-4-chlorophenyl ethylbromide,1-bromo-2-4-chlorophenyl ethane,benzene, 1-2-bromoethyl-4-chloro,p-chlorophenethyl bromide,4-chlorophenethyl bromide 97,p-chloro-.beta.-phenethyl bromide,1-chloro-4-2-bromoethyl benzene,acmc-20aa8v PubChem CID: 23029 IUPAC Name: 1-(2-bromoethyl)-4-chlorobenzene SMILES: C1=CC(=CC=C1CCBr)Cl

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Specifications

PubChem CID	23029
CAS	6529-53-9
Molecular Weight (g/mol)	219.51
SMILES	C1=CC(=CC=C1CCBr)Cl
Synonym	1-2-bromoethyl-4-chlorobenzene,4-chlorophenethyl bromide,2-4-chlorophenyl ethylbromide,1-bromo-2-4-chlorophenyl ethane,benzene, 1-2-bromoethyl-4-chloro,p-chlorophenethyl bromide,4-chlorophenethyl bromide 97,p-chloro-.beta.-phenethyl bromide,1-chloro-4-2-bromoethyl benzene,acmc-20aa8v
IUPAC Name	1-(2-bromoethyl)-4-chlorobenzene
InChI Key	YAFMYKFAUNCQPU-UHFFFAOYSA-N
Molecular Formula	C₈H₈BrCl

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4-Chloro-5-fluoro-o-phenylenediamine, 98%

CAS: 139512-70-2 Molecular Formula: C6H6ClFN2 Molecular Weight (g/mol): 160.58 MDL Number: MFCD00042485 InChI Key: BSMPRJISGCTCDC-UHFFFAOYSA-N PubChem CID: 735773 IUPAC Name: 4-chloro-5-fluorobenzene-1,2-diamine SMILES: NC1=CC(F)=C(Cl)C=C1N

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Specifications

PubChem CID	735773
CAS	139512-70-2
Molecular Weight (g/mol)	160.58
MDL Number	MFCD00042485
SMILES	NC1=CC(F)=C(Cl)C=C1N
IUPAC Name	4-chloro-5-fluorobenzene-1,2-diamine
InChI Key	BSMPRJISGCTCDC-UHFFFAOYSA-N
Molecular Formula	C6H6ClFN2

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4-Chlorophenylacetic acid, 98%

CAS: 1878-66-6 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00004344 InChI Key: CDPKJZJVTHSESZ-UHFFFAOYSA-N Synonym: 4-chlorophenylacetic acid,2-4-chlorophenyl acetic acid,4-chlorophenyl acetic acid,4-chlorobenzeneacetic acid,p-chlorophenylacetic acid,benzeneacetic acid, 4-chloro,p-chlorophenyl acetic acid,2-p-chlorophenyl acetic acid,acetic acid, p-chlorophenyl PubChem CID: 15880 ChEBI: CHEBI:30749 IUPAC Name: 2-(4-chlorophenyl)acetic acid SMILES: OC(=O)CC1=CC=C(Cl)C=C1

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Specifications

PubChem CID	15880
CAS	1878-66-6
Molecular Weight (g/mol)	170.59
ChEBI	CHEBI:30749
MDL Number	MFCD00004344
SMILES	OC(=O)CC1=CC=C(Cl)C=C1
Synonym	4-chlorophenylacetic acid,2-4-chlorophenyl acetic acid,4-chlorophenyl acetic acid,4-chlorobenzeneacetic acid,p-chlorophenylacetic acid,benzeneacetic acid, 4-chloro,p-chlorophenyl acetic acid,2-p-chlorophenyl acetic acid,acetic acid, p-chlorophenyl
IUPAC Name	2-(4-chlorophenyl)acetic acid
InChI Key	CDPKJZJVTHSESZ-UHFFFAOYSA-N
Molecular Formula	C8H7ClO2

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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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3-Chloro-4-methylbenzeneboronic acid, 97%

CAS: 175883-63-3 Molecular Formula: C7H8BClO2 Molecular Weight (g/mol): 170.40 MDL Number: MFCD04039010 InChI Key: YTJUYWRCAZWVSX-UHFFFAOYSA-N Synonym: 3-chloro-4-methylphenyl boronic acid,3-chloro-4-methylbenzeneboronic acid,3-chloro-4-methylphenylboronicacid,3-chloro-p-tolylboronic acid,boronic acid, 3-chloro-4-methylphenyl,pubchem5132,3-chloro-4-methyl-phenyl boronic acid,acmc-209eaq,ksc489k9f,3-chloro-4-methylphenyl-boronic acid PubChem CID: 3854610 IUPAC Name: (3-chloro-4-methylphenyl)boronic acid SMILES: CC1=CC=C(C=C1Cl)B(O)O

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Specifications

PubChem CID	3854610
CAS	175883-63-3
Molecular Weight (g/mol)	170.40
MDL Number	MFCD04039010
SMILES	CC1=CC=C(C=C1Cl)B(O)O
Synonym	3-chloro-4-methylphenyl boronic acid,3-chloro-4-methylbenzeneboronic acid,3-chloro-4-methylphenylboronicacid,3-chloro-p-tolylboronic acid,boronic acid, 3-chloro-4-methylphenyl,pubchem5132,3-chloro-4-methyl-phenyl boronic acid,acmc-209eaq,ksc489k9f,3-chloro-4-methylphenyl-boronic acid
IUPAC Name	(3-chloro-4-methylphenyl)boronic acid
InChI Key	YTJUYWRCAZWVSX-UHFFFAOYSA-N
Molecular Formula	C7H8BClO2

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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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4-Chlorobenzonitrile, 99%

CAS: 623-03-0 Molecular Formula: C7H4ClN Molecular Weight (g/mol): 137.57 MDL Number: MFCD00001813 InChI Key: GJNGXPDXRVXSEH-UHFFFAOYSA-N Synonym: p-chlorobenzonitrile,benzonitrile, 4-chloro,p-cyanochlorobenzene,benzonitrile, p-chloro,4-cyanochlorobenzene,nitril kyseliny p-chlorbenzoove,p-chlorbenzonitrile,unii-4z0hgp3a8a,pcbn,4-chloro benzonitrile PubChem CID: 12163 IUPAC Name: 4-chlorobenzonitrile SMILES: ClC1=CC=C(C=C1)C#N

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Specifications

PubChem CID	12163
CAS	623-03-0
Molecular Weight (g/mol)	137.57
MDL Number	MFCD00001813
SMILES	ClC1=CC=C(C=C1)C#N
Synonym	p-chlorobenzonitrile,benzonitrile, 4-chloro,p-cyanochlorobenzene,benzonitrile, p-chloro,4-cyanochlorobenzene,nitril kyseliny p-chlorbenzoove,p-chlorbenzonitrile,unii-4z0hgp3a8a,pcbn,4-chloro benzonitrile
IUPAC Name	4-chlorobenzonitrile
InChI Key	GJNGXPDXRVXSEH-UHFFFAOYSA-N
Molecular Formula	C7H4ClN

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5-Amino-1-(3-chlorophenyl)-1H-pyrazole-4-carbonitrile, 97%

CAS: 51516-68-8 Molecular Formula: C10H7ClN4 Molecular Weight (g/mol): 218.64 MDL Number: MFCD00128298 InChI Key: VRKRSWGTAMOYEV-UHFFFAOYSA-N Synonym: 5-amino-1-3-chlorophenyl-1h-pyrazole-4-carbonitrile,5-amino-1-3-chlorophenyl pyrazole-4-carbonitrile,5-amino-1-3-chlorophenyl-1h-pyrazole-,5-amino-1-3-chloro-phenyl-1h-pyrazole-4-carbonit,1h-pyrazole-4-carbonitrile,5-amino-1-3-chlorophenyl,1h-pyrazole-4-carbonitrile, 5-amino-1-3-chlorophenyl PubChem CID: 734496 IUPAC Name: 5-amino-1-(3-chlorophenyl)pyrazole-4-carbonitrile SMILES: NC1=C(C=NN1C1=CC=CC(Cl)=C1)C#N

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Specifications

PubChem CID	734496
CAS	51516-68-8
Molecular Weight (g/mol)	218.64
MDL Number	MFCD00128298
SMILES	NC1=C(C=NN1C1=CC=CC(Cl)=C1)C#N
Synonym	5-amino-1-3-chlorophenyl-1h-pyrazole-4-carbonitrile,5-amino-1-3-chlorophenyl pyrazole-4-carbonitrile,5-amino-1-3-chlorophenyl-1h-pyrazole-,5-amino-1-3-chloro-phenyl-1h-pyrazole-4-carbonit,1h-pyrazole-4-carbonitrile,5-amino-1-3-chlorophenyl,1h-pyrazole-4-carbonitrile, 5-amino-1-3-chlorophenyl
IUPAC Name	5-amino-1-(3-chlorophenyl)pyrazole-4-carbonitrile
InChI Key	VRKRSWGTAMOYEV-UHFFFAOYSA-N
Molecular Formula	C10H7ClN4

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Potassium tetrakis(4-chlorophenyl)borate, 98%

CAS: 14680-77-4 Molecular Formula: C24H16BCl4K Molecular Weight (g/mol): 496.10 MDL Number: MFCD00043105 InChI Key: VHPYLDPFVZBNQT-UHFFFAOYSA-N Synonym: potassium tetrakis 4-chlorophenyl borate,tetrakis 4-chlorophenyl boron potassium,k-tcpb,potassium tetrakis 4-chlorophenyl boranuide,potassium tetrakis 4-chlorophenyl borate, selectophore tm PubChem CID: 23679691 IUPAC Name: potassium;tetrakis(4-chlorophenyl)boranuide SMILES: [B+3].[K+].ClC1=CC=C[C-]=C1.ClC1=CC=C[C-]=C1.ClC1=CC=C[C-]=C1.ClC1=CC=C[C-]=C1

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Specifications

PubChem CID	23679691
CAS	14680-77-4
Molecular Weight (g/mol)	496.10
MDL Number	MFCD00043105
SMILES	[B+3].[K+].ClC1=CC=C[C-]=C1.ClC1=CC=C[C-]=C1.ClC1=CC=C[C-]=C1.ClC1=CC=C[C-]=C1
Synonym	potassium tetrakis 4-chlorophenyl borate,tetrakis 4-chlorophenyl boron potassium,k-tcpb,potassium tetrakis 4-chlorophenyl boranuide,potassium tetrakis 4-chlorophenyl borate, selectophore tm
IUPAC Name	potassium;tetrakis(4-chlorophenyl)boranuide
InChI Key	VHPYLDPFVZBNQT-UHFFFAOYSA-N
Molecular Formula	C24H16BCl4K

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3-chloro-5-fluoroaniline, 97%

CAS: 4863-91-6 Molecular Formula: C₆H₅ClFN Molecular Weight (g/mol): 145.56 MDL Number: MFCD03407962 InChI Key: LPIFAHAICWJMRR-UHFFFAOYSA-N Synonym: pubchem2953,acmc-209kdj,3-chloro-5-fluorobenzenamine,5-chloro-3-fluorophenylamine,ksc493m9f,3-chloro-5-fluoro-phenylamine,buttpark 44\01-96 PubChem CID: 2734838 IUPAC Name: 3-chloro-5-fluoroaniline SMILES: C1=C(C=C(C=C1F)Cl)N

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Specifications

PubChem CID	2734838
CAS	4863-91-6
Molecular Weight (g/mol)	145.56
MDL Number	MFCD03407962
SMILES	C1=C(C=C(C=C1F)Cl)N
Synonym	pubchem2953,acmc-209kdj,3-chloro-5-fluorobenzenamine,5-chloro-3-fluorophenylamine,ksc493m9f,3-chloro-5-fluoro-phenylamine,buttpark 44\01-96
IUPAC Name	3-chloro-5-fluoroaniline
InChI Key	LPIFAHAICWJMRR-UHFFFAOYSA-N
Molecular Formula	C₆H₅ClFN

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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

Chlorobenzene

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