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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4-Chloro-3-fluoroaniline, 99%, Thermo Scientific Chemicals

CAS: 367-22-6 Molecular Formula: C6H5ClFN Molecular Weight (g/mol): 145.56 MDL Number: MFCD01090987 InChI Key: ACMJJQYSPUPMPN-UHFFFAOYSA-N Synonym: 3-fluoro-4-chloroaniline,4-chloro-3-fluoroanline,4-chloro-3-fluoro-phenylamine,benzenamine, 4-chloro-3-fluoro,4-chloro-3-fluorophenylamine,pubchem1516,acmc-1co9a,4-chloro-3-fluoro-aniline,4-chloro-3-fluorobenzenamine,ksc226g4r PubChem CID: 2736511 IUPAC Name: 4-chloro-3-fluoroaniline SMILES: NC1=CC=C(Cl)C(F)=C1

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Specifications

PubChem CID	2736511
CAS	367-22-6
Molecular Weight (g/mol)	145.56
MDL Number	MFCD01090987
SMILES	NC1=CC=C(Cl)C(F)=C1
Synonym	3-fluoro-4-chloroaniline,4-chloro-3-fluoroanline,4-chloro-3-fluoro-phenylamine,benzenamine, 4-chloro-3-fluoro,4-chloro-3-fluorophenylamine,pubchem1516,acmc-1co9a,4-chloro-3-fluoro-aniline,4-chloro-3-fluorobenzenamine,ksc226g4r
IUPAC Name	4-chloro-3-fluoroaniline
InChI Key	ACMJJQYSPUPMPN-UHFFFAOYSA-N
Molecular Formula	C6H5ClFN

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2-(3-Chlorophenyl)ethylboronic acid pinacol ester, 97%

CAS: 1315277-53-2 Molecular Formula: C14H20BClO2 Molecular Weight (g/mol): 266.572 MDL Number: MFCD12546188 InChI Key: WZAJMSPJXKZSTL-UHFFFAOYSA-N Synonym: 2-2-3-chlorophenyl ethyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-3-chlorophenethyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-3-chlorophenyl ethylboronic acid pinacol ester PubChem CID: 73995113 IUPAC Name: 2-[2-(3-chlorophenyl)ethyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)CCC2=CC(=CC=C2)Cl

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Specifications

PubChem CID	73995113
CAS	1315277-53-2
Molecular Weight (g/mol)	266.572
MDL Number	MFCD12546188
SMILES	B1(OC(C(O1)(C)C)(C)C)CCC2=CC(=CC=C2)Cl
Synonym	2-2-3-chlorophenyl ethyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-3-chlorophenethyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-3-chlorophenyl ethylboronic acid pinacol ester
IUPAC Name	2-[2-(3-chlorophenyl)ethyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI Key	WZAJMSPJXKZSTL-UHFFFAOYSA-N
Molecular Formula	C14H20BClO2

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3-Chlorotoluene, 97%

CAS: 108-41-8 Molecular Formula: C7H7Cl Molecular Weight (g/mol): 126.58 MDL Number: MFCD00000595 InChI Key: OSOUNOBYRMOXQQ-UHFFFAOYSA-N Synonym: 3-chlorotoluene,m-chlorotoluene,benzene, 1-chloro-3-methyl,m-tolyl chloride,3-chloro-1-methylbenzene,1-methyl-3-chlorobenzene,toluene, m-chloro,meta-chlorotoluene,unii-5k8172k9tt,chlorotoluene 3- PubChem CID: 7931 IUPAC Name: 1-chloro-3-methylbenzene SMILES: CC1=CC=CC(Cl)=C1

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Specifications

PubChem CID	7931
CAS	108-41-8
Molecular Weight (g/mol)	126.58
MDL Number	MFCD00000595
SMILES	CC1=CC=CC(Cl)=C1
Synonym	3-chlorotoluene,m-chlorotoluene,benzene, 1-chloro-3-methyl,m-tolyl chloride,3-chloro-1-methylbenzene,1-methyl-3-chlorobenzene,toluene, m-chloro,meta-chlorotoluene,unii-5k8172k9tt,chlorotoluene 3-
IUPAC Name	1-chloro-3-methylbenzene
InChI Key	OSOUNOBYRMOXQQ-UHFFFAOYSA-N
Molecular Formula	C7H7Cl

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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4-Chlorophenylboronic acid, 97%

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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1-(4-Chlorophenyl)-1-cyclopropanecarboxylic acid, 99%

CAS: 72934-37-3 Molecular Formula: C₁₀H₉ClO₂ Molecular Weight (g/mol): 196.63 MDL Number: MFCD00001289 InChI Key: YAHLWSGIQJATGG-UHFFFAOYSA-N Synonym: 1-4-chlorophenyl cyclopropanecarboxylic acid,1-4-chlorophenyl cyclopropane-1-carboxylic acid,1-4-chlorophenyl-1-cyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-4-chlorophenyl,1-p-chlorophenyl cyclopropanecarboxylic acid,acmc-209oos,1-4-chlorophenyl cyclopropanecarboxylicacid,1-4chloro-phenyl-cyclopropylcarboxylic acid,1-4-chloro-phenyl-cyclopropylcarboxylic acid PubChem CID: 98606 IUPAC Name: 1-(4-chlorophenyl)cyclopropane-1-carboxylic acid SMILES: C1CC1(C2=CC=C(C=C2)Cl)C(=O)O

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Specifications

PubChem CID	98606
CAS	72934-37-3
Molecular Weight (g/mol)	196.63
MDL Number	MFCD00001289
SMILES	C1CC1(C2=CC=C(C=C2)Cl)C(=O)O
Synonym	1-4-chlorophenyl cyclopropanecarboxylic acid,1-4-chlorophenyl cyclopropane-1-carboxylic acid,1-4-chlorophenyl-1-cyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-4-chlorophenyl,1-p-chlorophenyl cyclopropanecarboxylic acid,acmc-209oos,1-4-chlorophenyl cyclopropanecarboxylicacid,1-4chloro-phenyl-cyclopropylcarboxylic acid,1-4-chloro-phenyl-cyclopropylcarboxylic acid
IUPAC Name	1-(4-chlorophenyl)cyclopropane-1-carboxylic acid
InChI Key	YAHLWSGIQJATGG-UHFFFAOYSA-N
Molecular Formula	C₁₀H₉ClO₂

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1-(4-Chlorophenyl)-3-buten-1-ol, 97%

CAS: 14506-33-3 Molecular Formula: C10H11ClO Molecular Weight (g/mol): 182.647 MDL Number: MFCD03427246 InChI Key: GJODRJDLQVBTMF-UHFFFAOYSA-N Synonym: 1-4-chlorophenyl-3-buten-1-ol,1-4-chlorophenyl but-3-en-1-ol,benzenemethanol,4-chloro-a-2-propen-1-yl,4-4-chlorophenyl-1-buten-4-ol,1-4-chloro-phenyl-but-3-en-1-ol,acmc-20apb1,4-chloro-alpha-allylbenzyl alcohol,4-4-chlorophenyl but-1-en-4-ol,1-4-chlorophenyl-but-3-en-1-ol PubChem CID: 2757771 IUPAC Name: 1-(4-chlorophenyl)but-3-en-1-ol SMILES: C=CCC(C1=CC=C(C=C1)Cl)O

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Specifications

PubChem CID	2757771
CAS	14506-33-3
Molecular Weight (g/mol)	182.647
MDL Number	MFCD03427246
SMILES	C=CCC(C1=CC=C(C=C1)Cl)O
Synonym	1-4-chlorophenyl-3-buten-1-ol,1-4-chlorophenyl but-3-en-1-ol,benzenemethanol,4-chloro-a-2-propen-1-yl,4-4-chlorophenyl-1-buten-4-ol,1-4-chloro-phenyl-but-3-en-1-ol,acmc-20apb1,4-chloro-alpha-allylbenzyl alcohol,4-4-chlorophenyl but-1-en-4-ol,1-4-chlorophenyl-but-3-en-1-ol
IUPAC Name	1-(4-chlorophenyl)but-3-en-1-ol
InChI Key	GJODRJDLQVBTMF-UHFFFAOYSA-N
Molecular Formula	C10H11ClO

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1-(2-Chlorophenyl)ethanol, 96%

CAS: 13524-04-4 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.609 MDL Number: MFCD00041037 InChI Key: DDUBOVLGCYUYFX-UHFFFAOYSA-N Synonym: 1-2-chlorophenyl ethanol,1-2-chlorophenyl ethan-1-ol,2-chloro-alpha-methylbenzyl alcohol,1-2-chlorophenyl-1-ethanol,benzenemethanol, 2-chloro-.alpha.-methyl,benzenemethanol, 2-chloro-alpha-methyl,benzyl alcohol, o-chloro-.alpha.-methyl,1-2-chloro-phenyl-ethanol,1-2-chlorophenyl ethyl alcohol,1-2'-chlorophenyl-1-hydroxyethane PubChem CID: 26082 IUPAC Name: 1-(2-chlorophenyl)ethanol SMILES: CC(C1=CC=CC=C1Cl)O

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Specifications

PubChem CID	26082
CAS	13524-04-4
Molecular Weight (g/mol)	156.609
MDL Number	MFCD00041037
SMILES	CC(C1=CC=CC=C1Cl)O
Synonym	1-2-chlorophenyl ethanol,1-2-chlorophenyl ethan-1-ol,2-chloro-alpha-methylbenzyl alcohol,1-2-chlorophenyl-1-ethanol,benzenemethanol, 2-chloro-.alpha.-methyl,benzenemethanol, 2-chloro-alpha-methyl,benzyl alcohol, o-chloro-.alpha.-methyl,1-2-chloro-phenyl-ethanol,1-2-chlorophenyl ethyl alcohol,1-2'-chlorophenyl-1-hydroxyethane
IUPAC Name	1-(2-chlorophenyl)ethanol
InChI Key	DDUBOVLGCYUYFX-UHFFFAOYSA-N
Molecular Formula	C8H9ClO

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3-chlorophenylacetylene, 97%

CAS: 766-83-6 Molecular Formula: C₈H₅Cl Molecular Weight (g/mol): 136.58 MDL Number: MFCD03839984 InChI Key: GRBJPHPMYOUMJV-UHFFFAOYSA-N Synonym: 3-chlorophenylacetylene,3-chlorophenyl acetylene,3'-chlorophenyl acetylene,3-chloro-1-ethynylbenzene,benzene, 1-chloro-3-ethynyl,m-chlorophenylacetylene,1-chloro-3-ethynyl-benzene,3'-chlorophenylacetylene,3-chloro phenyl acetylene PubChem CID: 123086 IUPAC Name: 1-chloro-3-ethynylbenzene SMILES: C#CC1=CC(=CC=C1)Cl

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Specifications

PubChem CID	123086
CAS	766-83-6
Molecular Weight (g/mol)	136.58
MDL Number	MFCD03839984
SMILES	C#CC1=CC(=CC=C1)Cl
Synonym	3-chlorophenylacetylene,3-chlorophenyl acetylene,3'-chlorophenyl acetylene,3-chloro-1-ethynylbenzene,benzene, 1-chloro-3-ethynyl,m-chlorophenylacetylene,1-chloro-3-ethynyl-benzene,3'-chlorophenylacetylene,3-chloro phenyl acetylene
IUPAC Name	1-chloro-3-ethynylbenzene
InChI Key	GRBJPHPMYOUMJV-UHFFFAOYSA-N
Molecular Formula	C₈H₅Cl

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1-Chloro-4-ethylbenzene, 97%, Thermo Scientific Chemicals

CAS: 622-98-0 Molecular Formula: C8H9Cl Molecular Weight (g/mol): 140.61 MDL Number: MFCD00040855 InChI Key: GPOFSFLJOIAMSA-UHFFFAOYSA-N Synonym: benzene, 1-chloro-4-ethyl,p-chloroethylbenzene,4-chloroethylbenzene,4-ethylchlorobenzene,acmc-20aovw,p-chlorophenyl ethane,4-chloro ethylbenzene,1-ethyl-4-chlorobenzene,4-chloro-1-ethylbenzene,1-chloro-4-ethyl benzene PubChem CID: 69330 IUPAC Name: 1-chloro-4-ethylbenzene SMILES: CCC1=CC=C(C=C1)Cl

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Specifications

PubChem CID	69330
CAS	622-98-0
Molecular Weight (g/mol)	140.61
MDL Number	MFCD00040855
SMILES	CCC1=CC=C(C=C1)Cl
Synonym	benzene, 1-chloro-4-ethyl,p-chloroethylbenzene,4-chloroethylbenzene,4-ethylchlorobenzene,acmc-20aovw,p-chlorophenyl ethane,4-chloro ethylbenzene,1-ethyl-4-chlorobenzene,4-chloro-1-ethylbenzene,1-chloro-4-ethyl benzene
IUPAC Name	1-chloro-4-ethylbenzene
InChI Key	GPOFSFLJOIAMSA-UHFFFAOYSA-N
Molecular Formula	C8H9Cl

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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

Chlorobenzene

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