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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1-Bromo-2-chlorobenzene, 98+%

CAS: 694-80-4 Molecular Formula: C6H4BrCl Molecular Weight (g/mol): 191.452 MDL Number: MFCD00000532 InChI Key: QBELEDRHMPMKHP-UHFFFAOYSA-N Synonym: 2-bromochlorobenzene,o-bromochlorobenzene,2-chlorobromobenzene,o-chlorobromobenzene,benzene, 1-bromo-2-chloro,2-bromo-1-chlorobenzene,1-chloro-2-bromobenzene,benzene, bromochloro,unii-pec7z3yx6p,1-bromo-2-chloro-benzene PubChem CID: 12754 IUPAC Name: 1-bromo-2-chlorobenzene SMILES: C1=CC=C(C(=C1)Cl)Br

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Specifications

PubChem CID	12754
CAS	694-80-4
Molecular Weight (g/mol)	191.452
MDL Number	MFCD00000532
SMILES	C1=CC=C(C(=C1)Cl)Br
Synonym	2-bromochlorobenzene,o-bromochlorobenzene,2-chlorobromobenzene,o-chlorobromobenzene,benzene, 1-bromo-2-chloro,2-bromo-1-chlorobenzene,1-chloro-2-bromobenzene,benzene, bromochloro,unii-pec7z3yx6p,1-bromo-2-chloro-benzene
IUPAC Name	1-bromo-2-chlorobenzene
InChI Key	QBELEDRHMPMKHP-UHFFFAOYSA-N
Molecular Formula	C6H4BrCl

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alpha-Bromo-4-chlorophenylacetic acid, 97%

CAS: 3381-73-5 Molecular Formula: C8H6BrClO2 Molecular Weight (g/mol): 249.49 MDL Number: MFCD08276760 InChI Key: KKOAAWLOOHBFQP-UHFFFAOYNA-N Synonym: 2-bromo-2-4-chlorophenyl acetic acid,alpha-bromo-4-chlorophenylacetic acid,bromo 4-chlorophenyl acetic acid,acmc-1ct0u,bromo-4-chlorophenyl acetic acid,bromo-4-chloro-phenyl acetic acid,bromo-4-chloro-phenyl-acetic acid,2-bromo-2-4-chlorophenyl aceticacid,alpha-bromo-p-chloro phenylacetic acid,alpha-bromo-p-chlorophenyl acetic acid PubChem CID: 10490868 IUPAC Name: 2-bromo-2-(4-chlorophenyl)acetic acid SMILES: OC(=O)C(Br)C1=CC=C(Cl)C=C1

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Specifications

PubChem CID	10490868
CAS	3381-73-5
Molecular Weight (g/mol)	249.49
MDL Number	MFCD08276760
SMILES	OC(=O)C(Br)C1=CC=C(Cl)C=C1
Synonym	2-bromo-2-4-chlorophenyl acetic acid,alpha-bromo-4-chlorophenylacetic acid,bromo 4-chlorophenyl acetic acid,acmc-1ct0u,bromo-4-chlorophenyl acetic acid,bromo-4-chloro-phenyl acetic acid,bromo-4-chloro-phenyl-acetic acid,2-bromo-2-4-chlorophenyl aceticacid,alpha-bromo-p-chloro phenylacetic acid,alpha-bromo-p-chlorophenyl acetic acid
IUPAC Name	2-bromo-2-(4-chlorophenyl)acetic acid
InChI Key	KKOAAWLOOHBFQP-UHFFFAOYNA-N
Molecular Formula	C8H6BrClO2

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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

Chlorobenzene, 99.5%, Extra Dry over Molecular Sieve, AcroSeal™

CAS: 108-90-7 Molecular Formula: C6H5Cl Molecular Weight (g/mol): 112.556 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
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-Chlorophenyl isocyanate, 98%

CAS: 104-12-1 Molecular Formula: C₇H₄ClNO Molecular Weight (g/mol): 153.57 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)	153.57
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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2-Chloro-4-fluoroaniline, 97%

CAS: 2106-02-7 Molecular Formula: C6H5ClFN Molecular Weight (g/mol): 145.56 MDL Number: MFCD00042530

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Specifications

CAS	2106-02-7
Molecular Weight (g/mol)	145.56
MDL Number	MFCD00042530
Molecular Formula	C6H5ClFN

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2,4,6-Trichlorobenzonitrile, 97+%

CAS: 6575-05-9 MDL Number: MFCD00052711

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Specifications

CAS	6575-05-9
MDL Number	MFCD00052711

PESTANAL™ 3-Chlorotoluene Analytical Standard, MilliporeSigma™ Supelco™

3-Chlorotoluene is a chlorinated solvent, and a major environmental pollutant. It is primarily used in textile, peroxide, pesticide, pharmaceutical, and dye industries.

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4-Chloromandelic acid, 98%

CAS: 492-86-4 Molecular Formula: C8H7ClO3 Molecular Weight (g/mol): 186.591 MDL Number: MFCD00042724 InChI Key: BWSFWXSSALIZAU-UHFFFAOYSA-N Synonym: 4-chloromandelic acid,2-4-chlorophenyl-2-hydroxyacetic acid,p-chloromandelic acid,p-chloro mandelic acid,4-chloro-dl-mandelic acid,4-chloromandelic acid, pract.,benzeneacetic acid, 4-chloro-.alpha.-hydroxy,dl-4-chloromandelic acid,mandelic acid, p-chloro,4-chlorophenyl hydroxy acetic acid PubChem CID: 10299 IUPAC Name: 2-(4-chlorophenyl)-2-hydroxyacetic acid SMILES: C1=CC(=CC=C1C(C(=O)O)O)Cl

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Specifications

PubChem CID	10299
CAS	492-86-4
Molecular Weight (g/mol)	186.591
MDL Number	MFCD00042724
SMILES	C1=CC(=CC=C1C(C(=O)O)O)Cl
Synonym	4-chloromandelic acid,2-4-chlorophenyl-2-hydroxyacetic acid,p-chloromandelic acid,p-chloro mandelic acid,4-chloro-dl-mandelic acid,4-chloromandelic acid, pract.,benzeneacetic acid, 4-chloro-.alpha.-hydroxy,dl-4-chloromandelic acid,mandelic acid, p-chloro,4-chlorophenyl hydroxy acetic acid
IUPAC Name	2-(4-chlorophenyl)-2-hydroxyacetic acid
InChI Key	BWSFWXSSALIZAU-UHFFFAOYSA-N
Molecular Formula	C8H7ClO3

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4-Chlorobenzyl isothiocyanate, 97%

CAS: 3694-45-9 Molecular Formula: C8H6ClNS Molecular Weight (g/mol): 183.653 MDL Number: MFCD00041116 InChI Key: DEHXIHUIYSXZNH-UHFFFAOYSA-N Synonym: 4-chlorobenzyl isothiocyanate,1-chloro-4-isothiocyanatomethyl benzene,p-chlorobenzyl isothiocyanate,benzene, 1-chloro-4-isothiocyanatomethyl,isothiocyanic acid, p-chlorobenzyl ester,4-chlorobenzylisothiocyanate,benzene, 1-chloro-4-isothiocyanatomethyl-9ci,acmc-1cng5,wln: scn1r dg,p-chlorobenzylisothiocyanate PubChem CID: 19408 IUPAC Name: 1-chloro-4-(isothiocyanatomethyl)benzene SMILES: C1=CC(=CC=C1CN=C=S)Cl

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Specifications

PubChem CID	19408
CAS	3694-45-9
Molecular Weight (g/mol)	183.653
MDL Number	MFCD00041116
SMILES	C1=CC(=CC=C1CN=C=S)Cl
Synonym	4-chlorobenzyl isothiocyanate,1-chloro-4-isothiocyanatomethyl benzene,p-chlorobenzyl isothiocyanate,benzene, 1-chloro-4-isothiocyanatomethyl,isothiocyanic acid, p-chlorobenzyl ester,4-chlorobenzylisothiocyanate,benzene, 1-chloro-4-isothiocyanatomethyl-9ci,acmc-1cng5,wln: scn1r dg,p-chlorobenzylisothiocyanate
IUPAC Name	1-chloro-4-(isothiocyanatomethyl)benzene
InChI Key	DEHXIHUIYSXZNH-UHFFFAOYSA-N
Molecular Formula	C8H6ClNS

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4-Chlorobenzeneboronic acid pinacol ester, 97%

CAS: 195062-61-4 Molecular Formula: C12H16BClO2 Molecular Weight (g/mol): 238.52 MDL Number: MFCD05663875 InChI Key: NYARTXMDWRAVIX-UHFFFAOYSA-N PubChem CID: 10633712 IUPAC Name: 2-(4-chlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(Cl)C=C1

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Specifications

PubChem CID	10633712
CAS	195062-61-4
Molecular Weight (g/mol)	238.52
MDL Number	MFCD05663875
SMILES	CC1(C)OB(OC1(C)C)C1=CC=C(Cl)C=C1
IUPAC Name	2-(4-chlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI Key	NYARTXMDWRAVIX-UHFFFAOYSA-N
Molecular Formula	C12H16BClO2

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3-Chloro-4-fluorobenzonitrile, 98+%

CAS: 117482-84-5 Molecular Formula: C7H3ClFN Molecular Weight (g/mol): 155.556 MDL Number: MFCD00015431 InChI Key: VAHXXQJJZKBZDX-UHFFFAOYSA-N Synonym: 3-chloro-4-fluoro-benzonitrile,benzonitrile, 3-chloro-4-fluoro,3-chloro-4-fluorobenzenecarbonitrile,pubchem1561,acmc-1bnmf,3-chloro-4-florobenzonitrile,3-chloro-4-fluorobenzontrile,ksc174m4n,3-chloro,4-fluorobenzonitrile,3-chloro4-fluorobenzo-nitrile PubChem CID: 145525 IUPAC Name: 3-chloro-4-fluorobenzonitrile SMILES: C1=CC(=C(C=C1C#N)Cl)F

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Specifications

PubChem CID	145525
CAS	117482-84-5
Molecular Weight (g/mol)	155.556
MDL Number	MFCD00015431
SMILES	C1=CC(=C(C=C1C#N)Cl)F
Synonym	3-chloro-4-fluoro-benzonitrile,benzonitrile, 3-chloro-4-fluoro,3-chloro-4-fluorobenzenecarbonitrile,pubchem1561,acmc-1bnmf,3-chloro-4-florobenzonitrile,3-chloro-4-fluorobenzontrile,ksc174m4n,3-chloro,4-fluorobenzonitrile,3-chloro4-fluorobenzo-nitrile
IUPAC Name	3-chloro-4-fluorobenzonitrile
InChI Key	VAHXXQJJZKBZDX-UHFFFAOYSA-N
Molecular Formula	C7H3ClFN

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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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