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

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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4-Bromo-1-chloro-2-ethylbenzene, 98+%

CAS: 289039-22-1 Molecular Formula: C8H8BrCl Molecular Weight (g/mol): 219.506 MDL Number: MFCD00672954 InChI Key: ILQNJGBEXZUYOI-UHFFFAOYSA-N Synonym: 5-bromo-2-chloroethylbenzene,acmc-1cnam,4-bromo-1-chloro-2-ethyl benzene,4-bromo-1-chloro-2-ethyl-benzene PubChem CID: 44119401 IUPAC Name: 4-bromo-1-chloro-2-ethylbenzene SMILES: CCC1=C(C=CC(=C1)Br)Cl

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Specifications

PubChem CID	44119401
CAS	289039-22-1
Molecular Weight (g/mol)	219.506
MDL Number	MFCD00672954
SMILES	CCC1=C(C=CC(=C1)Br)Cl
Synonym	5-bromo-2-chloroethylbenzene,acmc-1cnam,4-bromo-1-chloro-2-ethyl benzene,4-bromo-1-chloro-2-ethyl-benzene
IUPAC Name	4-bromo-1-chloro-2-ethylbenzene
InChI Key	ILQNJGBEXZUYOI-UHFFFAOYSA-N
Molecular Formula	C8H8BrCl

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(R)-(-)-2-Chloromandelic acid, ChiPros 99+%, ee 99+%

CAS: 52950-18-2 Molecular Formula: C8H7ClO3 Molecular Weight (g/mol): 186.591 MDL Number: MFCD00798429 InChI Key: RWOLDZZTBNYTMS-SSDOTTSWSA-N Synonym: r---2-chloromandelic acid,r-2-2-chlorophenyl-2-hydroxyacetic acid,r-2-chloromandelic acid,r-o-chloromandelic acid,2-chloro-d-mandelic acid,2r-2-2-chlorophenyl-2-hydroxyacetic acid,r-2-chlorophenyl hydroxy acetic acid,pubchem5742,ksc914s2l,r---2-chloromandelicacid PubChem CID: 2733641 IUPAC Name: (2R)-2-(2-chlorophenyl)-2-hydroxyacetic acid SMILES: C1=CC=C(C(=C1)C(C(=O)O)O)Cl

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Specifications

PubChem CID	2733641
CAS	52950-18-2
Molecular Weight (g/mol)	186.591
MDL Number	MFCD00798429
SMILES	C1=CC=C(C(=C1)C(C(=O)O)O)Cl
Synonym	r---2-chloromandelic acid,r-2-2-chlorophenyl-2-hydroxyacetic acid,r-2-chloromandelic acid,r-o-chloromandelic acid,2-chloro-d-mandelic acid,2r-2-2-chlorophenyl-2-hydroxyacetic acid,r-2-chlorophenyl hydroxy acetic acid,pubchem5742,ksc914s2l,r---2-chloromandelicacid
IUPAC Name	(2R)-2-(2-chlorophenyl)-2-hydroxyacetic acid
InChI Key	RWOLDZZTBNYTMS-SSDOTTSWSA-N
Molecular Formula	C8H7ClO3

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3-Chlorobenzonitrile, 99%

CAS: 766-84-7 Molecular Formula: C7H4ClN Molecular Weight (g/mol): 137.57 MDL Number: MFCD00001798 InChI Key: WBUOVKBZJOIOAE-UHFFFAOYSA-N Synonym: m-chlorobenzonitrile,benzonitrile, 3-chloro,m-chloro benzonitrile,m-cyanochlorobenzene,benzonitrile, m-chloro,3-chlorobenzenecarbonitrile,5-chlorobenzonitrile,3-chloro benzonitrile,3-chloro-benzonitrile,pubchem3624 PubChem CID: 13015 IUPAC Name: 3-chlorobenzonitrile SMILES: ClC1=CC=CC(=C1)C#N

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Specifications

PubChem CID	13015
CAS	766-84-7
Molecular Weight (g/mol)	137.57
MDL Number	MFCD00001798
SMILES	ClC1=CC=CC(=C1)C#N
Synonym	m-chlorobenzonitrile,benzonitrile, 3-chloro,m-chloro benzonitrile,m-cyanochlorobenzene,benzonitrile, m-chloro,3-chlorobenzenecarbonitrile,5-chlorobenzonitrile,3-chloro benzonitrile,3-chloro-benzonitrile,pubchem3624
IUPAC Name	3-chlorobenzonitrile
InChI Key	WBUOVKBZJOIOAE-UHFFFAOYSA-N
Molecular Formula	C7H4ClN

4-Bromochlorobenzene, 99%

CAS: 106-39-8 Molecular Formula: C6H4BrCl Molecular Weight (g/mol): 191.45 MDL Number: MFCD00000600 InChI Key: NHDODQWIKUYWMW-UHFFFAOYSA-N Synonym: 4-bromochlorobenzene,p-bromochlorobenzene,4-chlorobromobenzene,p-chlorobromobenzene,p-chlorophenyl bromide,benzene, 1-bromo-4-chloro,4-chlorophenyl bromide,1-chloro-4-bromobenzene,4-chloro-1-bromobenzene,p-bromoclorobenzene PubChem CID: 7806 IUPAC Name: 1-bromo-4-chlorobenzene SMILES: ClC1=CC=C(Br)C=C1

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Specifications

PubChem CID	7806
CAS	106-39-8
Molecular Weight (g/mol)	191.45
MDL Number	MFCD00000600
SMILES	ClC1=CC=C(Br)C=C1
Synonym	4-bromochlorobenzene,p-bromochlorobenzene,4-chlorobromobenzene,p-chlorobromobenzene,p-chlorophenyl bromide,benzene, 1-bromo-4-chloro,4-chlorophenyl bromide,1-chloro-4-bromobenzene,4-chloro-1-bromobenzene,p-bromoclorobenzene
IUPAC Name	1-bromo-4-chlorobenzene
InChI Key	NHDODQWIKUYWMW-UHFFFAOYSA-N
Molecular Formula	C6H4BrCl

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(S)-1-(2-Chlorophenyl)ethanol, 98%

CAS: 131864-71-6 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.609 MDL Number: MFCD06659506 InChI Key: DDUBOVLGCYUYFX-LURJTMIESA-N Synonym: s-1-2-chlorophenyl ethanol,1s-1-2-chlorophenyl ethan-1-ol,1s-1-2-chlorophenyl ethanol,s-1-2-chlorophenyl ethan-1-ol,pubchem5670,s-1-2-chloro-phenyl-ethanol,5-1-2-chloro-phenyl-ethanol,s-2-chloro-alpha-methylbenzyl alcohol,benzenemethanol,2-chloro-a-methyl-, as PubChem CID: 6999091 IUPAC Name: (1S)-1-(2-chlorophenyl)ethanol SMILES: CC(C1=CC=CC=C1Cl)O

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Specifications

PubChem CID	6999091
CAS	131864-71-6
Molecular Weight (g/mol)	156.609
MDL Number	MFCD06659506
SMILES	CC(C1=CC=CC=C1Cl)O
Synonym	s-1-2-chlorophenyl ethanol,1s-1-2-chlorophenyl ethan-1-ol,1s-1-2-chlorophenyl ethanol,s-1-2-chlorophenyl ethan-1-ol,pubchem5670,s-1-2-chloro-phenyl-ethanol,5-1-2-chloro-phenyl-ethanol,s-2-chloro-alpha-methylbenzyl alcohol,benzenemethanol,2-chloro-a-methyl-, as
IUPAC Name	(1S)-1-(2-chlorophenyl)ethanol
InChI Key	DDUBOVLGCYUYFX-LURJTMIESA-N
Molecular Formula	C8H9ClO

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3-Chlorobenzamide, 98+%, Thermo Scientific Chemicals

CAS: 618-48-4 Molecular Formula: C7H6ClNO Molecular Weight (g/mol): 155.58 MDL Number: MFCD00014799 InChI Key: MJTGQALMWUUPQM-UHFFFAOYSA-N Synonym: m-chlorobenzamide,benzamide, 3-chloro,3-chloro-benzamide,benzamide, m-chloro-8ci,benzamide, m-chloro,5-chlorobenzamide,pubchem3618,acmc-1b3cu,wce PubChem CID: 69254 ChEBI: CHEBI:10587 IUPAC Name: 3-chlorobenzamide SMILES: NC(=O)C1=CC=CC(Cl)=C1

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Specifications

PubChem CID	69254
CAS	618-48-4
Molecular Weight (g/mol)	155.58
ChEBI	CHEBI:10587
MDL Number	MFCD00014799
SMILES	NC(=O)C1=CC=CC(Cl)=C1
Synonym	m-chlorobenzamide,benzamide, 3-chloro,3-chloro-benzamide,benzamide, m-chloro-8ci,benzamide, m-chloro,5-chlorobenzamide,pubchem3618,acmc-1b3cu,wce
IUPAC Name	3-chlorobenzamide
InChI Key	MJTGQALMWUUPQM-UHFFFAOYSA-N
Molecular Formula	C7H6ClNO

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2-Chloro-4-fluorobenzonitrile, 98%

CAS: 60702-69-4 Molecular Formula: C7H3ClFN Molecular Weight (g/mol): 155.56 MDL Number: MFCD00042523 InChI Key: PGKPNNMOFHNZJX-UHFFFAOYSA-N Synonym: 4-fluoro-2-chlorobenzonitrile,benzonitrile, 2-chloro-4-fluoro,2-chloro-4-fluoro benzonitrile,2-chloro-4-fluoro-benzonitrile,2-chloro-4-fluorobenzenecarbonitrile,ncr bg df,pubchem3422,acmc-209mll,2-chloro-4fluorobenzonitrile,2-chloro4-fluorobenzonitrile PubChem CID: 109000 IUPAC Name: 2-chloro-4-fluorobenzonitrile SMILES: FC1=CC=C(C#N)C(Cl)=C1

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Specifications

PubChem CID	109000
CAS	60702-69-4
Molecular Weight (g/mol)	155.56
MDL Number	MFCD00042523
SMILES	FC1=CC=C(C#N)C(Cl)=C1
Synonym	4-fluoro-2-chlorobenzonitrile,benzonitrile, 2-chloro-4-fluoro,2-chloro-4-fluoro benzonitrile,2-chloro-4-fluoro-benzonitrile,2-chloro-4-fluorobenzenecarbonitrile,ncr bg df,pubchem3422,acmc-209mll,2-chloro-4fluorobenzonitrile,2-chloro4-fluorobenzonitrile
IUPAC Name	2-chloro-4-fluorobenzonitrile
InChI Key	PGKPNNMOFHNZJX-UHFFFAOYSA-N
Molecular Formula	C7H3ClFN

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4-Chlorobenzeneboronic acid, 98+%

CAS: 1679-18-1 Molecular Formula: C6H6BClO2 Molecular Weight (g/mol): 156.37 MDL Number: MFCD00039137 InChI Key: CAYQIZIAYYNFCS-UHFFFAOYSA-N Synonym: 4-chlorophenyl boronic acid,4-chlorobenzeneboronic acid,p-chlorophenylboronic acid,benzeneboronic acid, p-chloro,p-chlorobenzeneboronic acid,boronic acid, 4-chlorophenyl,boronic acid, p-chlorophenyl,4-chlorophenyl boranediol,4-chlorophenylbornic acid PubChem CID: 74299 IUPAC Name: (4-chlorophenyl)boronic acid SMILES: OB(O)C1=CC=C(Cl)C=C1

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Specifications

PubChem CID	74299
CAS	1679-18-1
Molecular Weight (g/mol)	156.37
MDL Number	MFCD00039137
SMILES	OB(O)C1=CC=C(Cl)C=C1
Synonym	4-chlorophenyl boronic acid,4-chlorobenzeneboronic acid,p-chlorophenylboronic acid,benzeneboronic acid, p-chloro,p-chlorobenzeneboronic acid,boronic acid, 4-chlorophenyl,boronic acid, p-chlorophenyl,4-chlorophenyl boranediol,4-chlorophenylbornic acid
IUPAC Name	(4-chlorophenyl)boronic acid
InChI Key	CAYQIZIAYYNFCS-UHFFFAOYSA-N
Molecular Formula	C6H6BClO2

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2-Chloro-6-fluoroaniline, 98%

CAS: 363-51-9 Molecular Formula: C6H5ClFN Molecular Weight (g/mol): 145.56 MDL Number: MFCD00040309 InChI Key: ZJLAWMDJTMMTQB-UHFFFAOYSA-N Synonym: benzenamine, 2-chloro-6-fluoro,2-chloro-6-fluoro-aniline,2-chloro-6-fluoro-phenylamine,6-chloro-2-fluorophenylamine,pubchem1528,2-fluoro-6-chloroaniline,acmc-209im1,2-chloro-6-fluoro aniline,2-chloro-6-fluorobenzenamine,2-chloro-6-fluorophenylamine PubChem CID: 2734205 IUPAC Name: 2-chloro-6-fluoroaniline SMILES: NC1=C(F)C=CC=C1Cl

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Specifications

PubChem CID	2734205
CAS	363-51-9
Molecular Weight (g/mol)	145.56
MDL Number	MFCD00040309
SMILES	NC1=C(F)C=CC=C1Cl
Synonym	benzenamine, 2-chloro-6-fluoro,2-chloro-6-fluoro-aniline,2-chloro-6-fluoro-phenylamine,6-chloro-2-fluorophenylamine,pubchem1528,2-fluoro-6-chloroaniline,acmc-209im1,2-chloro-6-fluoro aniline,2-chloro-6-fluorobenzenamine,2-chloro-6-fluorophenylamine
IUPAC Name	2-chloro-6-fluoroaniline
InChI Key	ZJLAWMDJTMMTQB-UHFFFAOYSA-N
Molecular Formula	C6H5ClFN

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2-Chlorophenylacetic acid, 98%

CAS: 2444-36-2 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.592 MDL Number: MFCD00004317 InChI Key: IUJAAIZKRJJZGQ-UHFFFAOYSA-N Synonym: 2-chlorophenylacetic acid,o-chlorophenylacetic acid,2-2-chlorophenyl acetic acid,2-chlorophenyl acetic acid,2-chlorophenylaceticacid,benzeneacetic acid, 2-chloro,o-chlorophenyl acetic acid,acetic acid, o-chlorophenyl,2-chloro-benzeneacetic acid PubChem CID: 17124 IUPAC Name: 2-(2-chlorophenyl)acetic acid SMILES: C1=CC=C(C(=C1)CC(=O)O)Cl

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Specifications

PubChem CID	17124
CAS	2444-36-2
Molecular Weight (g/mol)	170.592
MDL Number	MFCD00004317
SMILES	C1=CC=C(C(=C1)CC(=O)O)Cl
Synonym	2-chlorophenylacetic acid,o-chlorophenylacetic acid,2-2-chlorophenyl acetic acid,2-chlorophenyl acetic acid,2-chlorophenylaceticacid,benzeneacetic acid, 2-chloro,o-chlorophenyl acetic acid,acetic acid, o-chlorophenyl,2-chloro-benzeneacetic acid
IUPAC Name	2-(2-chlorophenyl)acetic acid
InChI Key	IUJAAIZKRJJZGQ-UHFFFAOYSA-N
Molecular Formula	C8H7ClO2

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4-chlorotoluene, 98%

CAS: 106-43-4 Molecular Formula: C7H7Cl Molecular Weight (g/mol): 126.58 MDL Number: MFCD00000631 InChI Key: NPDACUSDTOMAMK-UHFFFAOYSA-N Synonym: 4-chlorotoluene,p-chlorotoluene,benzene, 1-chloro-4-methyl,p-tolyl chloride,toluene, p-chloro,1-methyl-4-chlorobenzene,4-chloro-1-methylbenzene,monochlorotoluene,para-chlorotoluene,unii-q8r236h42n PubChem CID: 7810 ChEBI: CHEBI:34401 IUPAC Name: 1-chloro-4-methylbenzene SMILES: CC1=CC=C(Cl)C=C1

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Specifications

PubChem CID	7810
CAS	106-43-4
Molecular Weight (g/mol)	126.58
ChEBI	CHEBI:34401
MDL Number	MFCD00000631
SMILES	CC1=CC=C(Cl)C=C1
Synonym	4-chlorotoluene,p-chlorotoluene,benzene, 1-chloro-4-methyl,p-tolyl chloride,toluene, p-chloro,1-methyl-4-chlorobenzene,4-chloro-1-methylbenzene,monochlorotoluene,para-chlorotoluene,unii-q8r236h42n
IUPAC Name	1-chloro-4-methylbenzene
InChI Key	NPDACUSDTOMAMK-UHFFFAOYSA-N
Molecular Formula	C7H7Cl

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3-Bromochlorobenzene, 99%

CAS: 108-37-2 Molecular Formula: C6H4BrCl Molecular Weight (g/mol): 191.45 MDL Number: MFCD00000568 InChI Key: JRGGUPZKKTVKOV-UHFFFAOYSA-N Synonym: 3-bromochlorobenzene,m-bromochlorobenzene,3-chlorobromobenzene,benzene, 1-bromo-3-chloro,m-chlorobromobenzene,1-chloro-3-bromobenzene,3-chlorophenyl bromide,m-chlorophenyl bromide,m-bromophenyl chloride,3-bromo-1-chlorobenzene PubChem CID: 7928 IUPAC Name: 1-bromo-3-chlorobenzene SMILES: ClC1=CC=CC(Br)=C1

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Specifications

PubChem CID	7928
CAS	108-37-2
Molecular Weight (g/mol)	191.45
MDL Number	MFCD00000568
SMILES	ClC1=CC=CC(Br)=C1
Synonym	3-bromochlorobenzene,m-bromochlorobenzene,3-chlorobromobenzene,benzene, 1-bromo-3-chloro,m-chlorobromobenzene,1-chloro-3-bromobenzene,3-chlorophenyl bromide,m-chlorophenyl bromide,m-bromophenyl chloride,3-bromo-1-chlorobenzene
IUPAC Name	1-bromo-3-chlorobenzene
InChI Key	JRGGUPZKKTVKOV-UHFFFAOYSA-N
Molecular Formula	C6H4BrCl

Chlorobenzene

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