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, ChiPros™ 97%, ee 98%

CAS: 27298-99-3 Molecular Formula: C8H10ClN Molecular Weight (g/mol): 155.625 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)	155.625
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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2'-Chloroacetanilide, 98+%

CAS: 533-17-5 Molecular Formula: C8H8ClNO Molecular Weight (g/mol): 169.61 MDL Number: MFCD00045169 InChI Key: KNVQTRVKSOEHPU-UHFFFAOYSA-N Synonym: 2'-chloroacetanilide,n-2-chlorophenyl acetamide,o-chloroacetanilide,acetamide, n-2-chlorophenyl,2'-chloro acetanilide,acetanilide, 2'-chloro,unii-20c42pa69y,a-chloroacetanilide,acetic acid, amide, n-2-chlorophenyl,acmc-209l5z PubChem CID: 10777 ChEBI: CHEBI:35087 IUPAC Name: N-(2-chlorophenyl)acetamide SMILES: CC(=O)NC1=CC=CC=C1Cl

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Specifications

PubChem CID	10777
CAS	533-17-5
Molecular Weight (g/mol)	169.61
ChEBI	CHEBI:35087
MDL Number	MFCD00045169
SMILES	CC(=O)NC1=CC=CC=C1Cl
Synonym	2'-chloroacetanilide,n-2-chlorophenyl acetamide,o-chloroacetanilide,acetamide, n-2-chlorophenyl,2'-chloro acetanilide,acetanilide, 2'-chloro,unii-20c42pa69y,a-chloroacetanilide,acetic acid, amide, n-2-chlorophenyl,acmc-209l5z
IUPAC Name	N-(2-chlorophenyl)acetamide
InChI Key	KNVQTRVKSOEHPU-UHFFFAOYSA-N
Molecular Formula	C8H8ClNO

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4-Chlorophenyl isocyanate, 98%

CAS: 104-12-1 Molecular Formula: C7H4ClNO Molecular Weight (g/mol): 153.565 MDL Number: MFCD00002024 InChI Key: ADAKRBAJFHTIEW-UHFFFAOYSA-N Synonym: 4-chlorophenyl isocyanate,p-chlorophenyl isocyanate,benzene, 1-chloro-4-isocyanato,pcpi,4-chloroisocyanatobenzene,para-chlorophenyl isocyanate,p-chlorfenylisokyanat,4-chlorophenylisocyanate,isocyanic acid, p-chlorophenyl ester,1-chloro-4-isocyanato-benzene PubChem CID: 7693 IUPAC Name: 1-chloro-4-isocyanatobenzene SMILES: C1=CC(=CC=C1N=C=O)Cl

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Specifications

PubChem CID	7693
CAS	104-12-1
Molecular Weight (g/mol)	153.565
MDL Number	MFCD00002024
SMILES	C1=CC(=CC=C1N=C=O)Cl
Synonym	4-chlorophenyl isocyanate,p-chlorophenyl isocyanate,benzene, 1-chloro-4-isocyanato,pcpi,4-chloroisocyanatobenzene,para-chlorophenyl isocyanate,p-chlorfenylisokyanat,4-chlorophenylisocyanate,isocyanic acid, p-chlorophenyl ester,1-chloro-4-isocyanato-benzene
IUPAC Name	1-chloro-4-isocyanatobenzene
InChI Key	ADAKRBAJFHTIEW-UHFFFAOYSA-N
Molecular Formula	C7H4ClNO

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4-Chloro-2-fluoroaniline, 98%

CAS: 57946-56-2 Molecular Formula: C6H5ClFN Molecular Weight (g/mol): 145.56 MDL Number: MFCD00010625 InChI Key: CSFDTBRRIBJILD-UHFFFAOYSA-N Synonym: 2-fluoro-4-chloroaniline,4-chloro-2-fluorobenzenamine,4-chloro-2-fluoro-phenylamine,benzenamine, 4-chloro-2-fluoro,4-chloro-2-fluoro-aniline,4-chloro-2-fluorophenylamine,pubchem1514,4-chloro-2fluoroaniline,4chloro-2-fluoroaniline,acmc-1at8a PubChem CID: 93898 IUPAC Name: 4-chloro-2-fluoroaniline SMILES: NC1=CC=C(Cl)C=C1F

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Specifications

PubChem CID	93898
CAS	57946-56-2
Molecular Weight (g/mol)	145.56
MDL Number	MFCD00010625
SMILES	NC1=CC=C(Cl)C=C1F
Synonym	2-fluoro-4-chloroaniline,4-chloro-2-fluorobenzenamine,4-chloro-2-fluoro-phenylamine,benzenamine, 4-chloro-2-fluoro,4-chloro-2-fluoro-aniline,4-chloro-2-fluorophenylamine,pubchem1514,4-chloro-2fluoroaniline,4chloro-2-fluoroaniline,acmc-1at8a
IUPAC Name	4-chloro-2-fluoroaniline
InChI Key	CSFDTBRRIBJILD-UHFFFAOYSA-N
Molecular Formula	C6H5ClFN

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2-Chlorophenethylalcohol, 98%

CAS: 19819-95-5 Molecular Formula: C₈H₉ClO Molecular Weight (g/mol): 156.61 MDL Number: MFCD00002888 InChI Key: IWNHTCBFRSCBQK-UHFFFAOYSA-N Synonym: 2-2-chlorophenyl ethanol,2-chlorophenethyl alcohol,benzeneethanol, 2-chloro,2-chlorophenethylalcohol,2-2-chlorophenyl ethan-1-ol,o-chlorophenethyl alcohol,o-chlorophenethylic alcohol,o-chlorophenylmethylcarbinol,chlorobenzene-ethanol,2-chlorobenzeneethanol PubChem CID: 88266 IUPAC Name: 2-(2-chlorophenyl)ethanol SMILES: C1=CC=C(C(=C1)CCO)Cl

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Specifications

PubChem CID	88266
CAS	19819-95-5
Molecular Weight (g/mol)	156.61
MDL Number	MFCD00002888
SMILES	C1=CC=C(C(=C1)CCO)Cl
Synonym	2-2-chlorophenyl ethanol,2-chlorophenethyl alcohol,benzeneethanol, 2-chloro,2-chlorophenethylalcohol,2-2-chlorophenyl ethan-1-ol,o-chlorophenethyl alcohol,o-chlorophenethylic alcohol,o-chlorophenylmethylcarbinol,chlorobenzene-ethanol,2-chlorobenzeneethanol
IUPAC Name	2-(2-chlorophenyl)ethanol
InChI Key	IWNHTCBFRSCBQK-UHFFFAOYSA-N
Molecular Formula	C₈H₉ClO

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3-Chlorobenzeneboronic acid, 97%

CAS: 63503-60-6 Molecular Formula: C6H6BClO2 Molecular Weight (g/mol): 156.37 MDL Number: MFCD00161354 InChI Key: SDEAGACSNFSZCU-UHFFFAOYSA-N Synonym: 3-chlorophenyl boronic acid,3-chlorobenzeneboronic acid,3-chlorophenyl boranediol,3-chlorophenylbornic acid,3-chloro benzene boronic acid,m-chlorophenylboronic acid,3-chloro-phenyl-boronic acid,boronic acid, 3-chlorophenyl,pubchem1785 PubChem CID: 2734323 IUPAC Name: (3-chlorophenyl)boronic acid SMILES: OB(O)C1=CC(Cl)=CC=C1

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Specifications

PubChem CID	2734323
CAS	63503-60-6
Molecular Weight (g/mol)	156.37
MDL Number	MFCD00161354
SMILES	OB(O)C1=CC(Cl)=CC=C1
Synonym	3-chlorophenyl boronic acid,3-chlorobenzeneboronic acid,3-chlorophenyl boranediol,3-chlorophenylbornic acid,3-chloro benzene boronic acid,m-chlorophenylboronic acid,3-chloro-phenyl-boronic acid,boronic acid, 3-chlorophenyl,pubchem1785
IUPAC Name	(3-chlorophenyl)boronic acid
InChI Key	SDEAGACSNFSZCU-UHFFFAOYSA-N
Molecular Formula	C6H6BClO2

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3-Chloro-5-fluoroaniline, 97%

CAS: 4863-91-6 Molecular Formula: C6H5ClFN Molecular Weight (g/mol): 145.561 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)	145.561
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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2,4,6-Trichloroaniline, 98+%

CAS: 634-93-5 Molecular Formula: C6H4Cl3N Molecular Weight (g/mol): 196.455 MDL Number: MFCD00007663 InChI Key: NATVSFWWYVJTAZ-UHFFFAOYSA-N Synonym: s-trichloroaniline,benzenamine, 2,4,6-trichloro,aniline, 2,4,6-trichloro,sym-trichloroaniline,2,4,6-trichlorobenzenamine,2,4,6-trichlorophenylamine,1-amino-2,4,6-trichlorobenzene,unii-j7ic72n9b0,ccris 601,pubchem9974 PubChem CID: 12471 IUPAC Name: 2,4,6-trichloroaniline SMILES: C1=C(C=C(C(=C1Cl)N)Cl)Cl

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Specifications

PubChem CID	12471
CAS	634-93-5
Molecular Weight (g/mol)	196.455
MDL Number	MFCD00007663
SMILES	C1=C(C=C(C(=C1Cl)N)Cl)Cl
Synonym	s-trichloroaniline,benzenamine, 2,4,6-trichloro,aniline, 2,4,6-trichloro,sym-trichloroaniline,2,4,6-trichlorobenzenamine,2,4,6-trichlorophenylamine,1-amino-2,4,6-trichlorobenzene,unii-j7ic72n9b0,ccris 601,pubchem9974
IUPAC Name	2,4,6-trichloroaniline
InChI Key	NATVSFWWYVJTAZ-UHFFFAOYSA-N
Molecular Formula	C6H4Cl3N

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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

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2,4,5-Trichloroaniline, 97%

CAS: 636-30-6 Molecular Formula: C6H4Cl3N Molecular Weight (g/mol): 196.455 MDL Number: MFCD00007662 InChI Key: GUMCAKKKNKYFEB-UHFFFAOYSA-N Synonym: benzenamine, 2,4,5-trichloro,unii-7xkk8s8wo0,aniline, 2,4,5-trichloro,7xkk8s8wo0,2,4,5-trichlorophenylamine,ccris 2882,pubchem3213,2,5-trichloroaniline,aniline,4,5-trichloro,2,4,5-trichloro aniline PubChem CID: 12487 IUPAC Name: 2,4,5-trichloroaniline SMILES: C1=C(C(=CC(=C1Cl)Cl)Cl)N

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Specifications

PubChem CID	12487
CAS	636-30-6
Molecular Weight (g/mol)	196.455
MDL Number	MFCD00007662
SMILES	C1=C(C(=CC(=C1Cl)Cl)Cl)N
Synonym	benzenamine, 2,4,5-trichloro,unii-7xkk8s8wo0,aniline, 2,4,5-trichloro,7xkk8s8wo0,2,4,5-trichlorophenylamine,ccris 2882,pubchem3213,2,5-trichloroaniline,aniline,4,5-trichloro,2,4,5-trichloro aniline
IUPAC Name	2,4,5-trichloroaniline
InChI Key	GUMCAKKKNKYFEB-UHFFFAOYSA-N
Molecular Formula	C6H4Cl3N

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1-Chloro-3,5-dimethoxybenzene, 98%

CAS: 7051-16-3 Molecular Formula: C8H9ClO2 Molecular Weight (g/mol): 172.608 MDL Number: MFCD00008382 InChI Key: WQHNWJBSROXROL-UHFFFAOYSA-N Synonym: 5-chloro-1,3-dimethoxybenzene,3,5-dimethoxychlorobenzene,benzene, 1-chloro-3,5-dimethoxy,5-chlororesorcinol dimethyl ether,1,3-dimethoxy-5-chlorobenzene,pubchem3042,benzene,5-dimethoxy,acmc-209oev,wln: gr co1 eo1,3,5-dimethoxyphenyl chloride PubChem CID: 81502 IUPAC Name: 1-chloro-3,5-dimethoxybenzene SMILES: COC1=CC(=CC(=C1)Cl)OC

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Specifications

PubChem CID	81502
CAS	7051-16-3
Molecular Weight (g/mol)	172.608
MDL Number	MFCD00008382
SMILES	COC1=CC(=CC(=C1)Cl)OC
Synonym	5-chloro-1,3-dimethoxybenzene,3,5-dimethoxychlorobenzene,benzene, 1-chloro-3,5-dimethoxy,5-chlororesorcinol dimethyl ether,1,3-dimethoxy-5-chlorobenzene,pubchem3042,benzene,5-dimethoxy,acmc-209oev,wln: gr co1 eo1,3,5-dimethoxyphenyl chloride
IUPAC Name	1-chloro-3,5-dimethoxybenzene
InChI Key	WQHNWJBSROXROL-UHFFFAOYSA-N
Molecular Formula	C8H9ClO2

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

Chlorobenzene

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