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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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

1,2,4-Trichlorobenzene, Spectrophotometric Grade, 99% min

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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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(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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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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4-Chlorothiobenzamide, 97%

CAS: 2521-24-6 Molecular Formula: C7H6ClNS Molecular Weight (g/mol): 171.64 MDL Number: MFCD00040956 InChI Key: OKPUICCJRDBRJT-UHFFFAOYSA-N Synonym: 4-chlorothiobenzamide,4-chlorobenzothioamide,p-chlorothiobenzamide,p-chlorobenzothiamide,4-chlorobenzene-1-carbothioamide,4-chloro-thiobenzamide,benzenecarbothioamide, 4-chloro,benzamide, p-chlorothio,benzamide, p-chlorothio-8ci,amino 4-chlorophenyl methane-1-thione PubChem CID: 2734826 SMILES: NC(=S)C1=CC=C(Cl)C=C1

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Specifications

PubChem CID	2734826
CAS	2521-24-6
Molecular Weight (g/mol)	171.64
MDL Number	MFCD00040956
SMILES	NC(=S)C1=CC=C(Cl)C=C1
Synonym	4-chlorothiobenzamide,4-chlorobenzothioamide,p-chlorothiobenzamide,p-chlorobenzothiamide,4-chlorobenzene-1-carbothioamide,4-chloro-thiobenzamide,benzenecarbothioamide, 4-chloro,benzamide, p-chlorothio,benzamide, p-chlorothio-8ci,amino 4-chlorophenyl methane-1-thione
InChI Key	OKPUICCJRDBRJT-UHFFFAOYSA-N
Molecular Formula	C7H6ClNS

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1-Bromo-3-chlorobenzene, 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

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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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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-Chloro-alpha-toluenesulfonyl chloride, 96%

CAS: 24974-73-0 Molecular Formula: C7H6Cl2O2S Molecular Weight (g/mol): 225.083 MDL Number: MFCD02683111 InChI Key: LXTGNVLBPVVMSL-UHFFFAOYSA-N Synonym: 3-chlorophenyl methanesulfonyl chloride,3-chloro-phenyl-methanesulfonyl chloride,chloro 3-chlorophenyl methyl sulfone,benzenemethanesulfonyl chloride, 3-chloro,pubchem5501,acmc-20an5u,3-chlorobenzylsulfonyl chloride,3-chlorophenyl methanesulfonylchloride,benzenemethanesulfonylchloride,3-chloro,benzenemethanesulfonylchloride, 3-chloro PubChem CID: 2757802 IUPAC Name: (3-chlorophenyl)methanesulfonyl chloride SMILES: C1=CC(=CC(=C1)Cl)CS(=O)(=O)Cl

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Specifications

PubChem CID	2757802
CAS	24974-73-0
Molecular Weight (g/mol)	225.083
MDL Number	MFCD02683111
SMILES	C1=CC(=CC(=C1)Cl)CS(=O)(=O)Cl
Synonym	3-chlorophenyl methanesulfonyl chloride,3-chloro-phenyl-methanesulfonyl chloride,chloro 3-chlorophenyl methyl sulfone,benzenemethanesulfonyl chloride, 3-chloro,pubchem5501,acmc-20an5u,3-chlorobenzylsulfonyl chloride,3-chlorophenyl methanesulfonylchloride,benzenemethanesulfonylchloride,3-chloro,benzenemethanesulfonylchloride, 3-chloro
IUPAC Name	(3-chlorophenyl)methanesulfonyl chloride
InChI Key	LXTGNVLBPVVMSL-UHFFFAOYSA-N
Molecular Formula	C7H6Cl2O2S

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3-Chloro-4-fluoroaniline, 98%

CAS: 367-21-5 Molecular Formula: C6H5ClFN Molecular Weight (g/mol): 145.56 MDL Number: MFCD00007767 InChI Key: YSEMCVGMNUUNRK-UHFFFAOYSA-N Synonym: benzenamine, 3-chloro-4-fluoro,3-chloro-4-fluorobenzenamine,3-chloro-4-fluoro-phenylamine,aniline, 3-chloro-4-fluoro,3-chloro-4-fluoro aniline,unii-7l63cc70uq,3-chloro-4-fluorophenylamine,4-fluoro-3-chloroaniline,3-chloro-4-fluoro-aniline,3-chlor-4-fluoranilin PubChem CID: 9708 IUPAC Name: 3-chloro-4-fluoroaniline SMILES: NC1=CC=C(F)C(Cl)=C1

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Specifications

PubChem CID	9708
CAS	367-21-5
Molecular Weight (g/mol)	145.56
MDL Number	MFCD00007767
SMILES	NC1=CC=C(F)C(Cl)=C1
Synonym	benzenamine, 3-chloro-4-fluoro,3-chloro-4-fluorobenzenamine,3-chloro-4-fluoro-phenylamine,aniline, 3-chloro-4-fluoro,3-chloro-4-fluoro aniline,unii-7l63cc70uq,3-chloro-4-fluorophenylamine,4-fluoro-3-chloroaniline,3-chloro-4-fluoro-aniline,3-chlor-4-fluoranilin
IUPAC Name	3-chloro-4-fluoroaniline
InChI Key	YSEMCVGMNUUNRK-UHFFFAOYSA-N
Molecular Formula	C6H5ClFN

Chlorobenzene

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