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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Potassium tetrakis(4-chlorophenyl)borate, 98%

CAS: 14680-77-4 Molecular Formula: C24H16BCl4K Molecular Weight (g/mol): 496.10 MDL Number: MFCD00043105 InChI Key: VHPYLDPFVZBNQT-UHFFFAOYSA-N Synonym: potassium tetrakis 4-chlorophenyl borate,tetrakis 4-chlorophenyl boron potassium,k-tcpb,potassium tetrakis 4-chlorophenyl boranuide,potassium tetrakis 4-chlorophenyl borate, selectophore tm PubChem CID: 23679691 IUPAC Name: potassium;tetrakis(4-chlorophenyl)boranuide SMILES: [B+3].[K+].ClC1=CC=C[C-]=C1.ClC1=CC=C[C-]=C1.ClC1=CC=C[C-]=C1.ClC1=CC=C[C-]=C1

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Specifications

PubChem CID	23679691
CAS	14680-77-4
Molecular Weight (g/mol)	496.10
MDL Number	MFCD00043105
SMILES	[B+3].[K+].ClC1=CC=C[C-]=C1.ClC1=CC=C[C-]=C1.ClC1=CC=C[C-]=C1.ClC1=CC=C[C-]=C1
Synonym	potassium tetrakis 4-chlorophenyl borate,tetrakis 4-chlorophenyl boron potassium,k-tcpb,potassium tetrakis 4-chlorophenyl boranuide,potassium tetrakis 4-chlorophenyl borate, selectophore tm
IUPAC Name	potassium;tetrakis(4-chlorophenyl)boranuide
InChI Key	VHPYLDPFVZBNQT-UHFFFAOYSA-N
Molecular Formula	C24H16BCl4K

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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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5-Chloro-m-phenylenediamine, 97%

CAS: 33786-89-9 Molecular Formula: C6H7ClN2 Molecular Weight (g/mol): 142.586 MDL Number: MFCD00014775 InChI Key: VZNUCJOYPXKLTA-UHFFFAOYSA-N Synonym: 5-chloro-m-phenylenediamine,3,5-diaminochlorobenzene,5-chloro-1,3-benzenediamine,1,3-benzenediamine, 5-chloro,5-chloro-1,3-phenylenediamine,ccris 2886,5-amino-3-chloroaniline,acmc-20am42,2-13-00-00029 beilstein handbook reference,5-chloro-1,3-diaminobenzene PubChem CID: 73335 IUPAC Name: 5-chlorobenzene-1,3-diamine SMILES: C1=C(C=C(C=C1N)Cl)N

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Specifications

PubChem CID	73335
CAS	33786-89-9
Molecular Weight (g/mol)	142.586
MDL Number	MFCD00014775
SMILES	C1=C(C=C(C=C1N)Cl)N
Synonym	5-chloro-m-phenylenediamine,3,5-diaminochlorobenzene,5-chloro-1,3-benzenediamine,1,3-benzenediamine, 5-chloro,5-chloro-1,3-phenylenediamine,ccris 2886,5-amino-3-chloroaniline,acmc-20am42,2-13-00-00029 beilstein handbook reference,5-chloro-1,3-diaminobenzene
IUPAC Name	5-chlorobenzene-1,3-diamine
InChI Key	VZNUCJOYPXKLTA-UHFFFAOYSA-N
Molecular Formula	C6H7ClN2

3-chloro-2-methylphenyl isothiocyanate, 97%, Thermo Scientific™

CAS: 19241-35-1 Molecular Formula: C8H6ClNS Molecular Weight (g/mol): 183.653 MDL Number: MFCD00022056 InChI Key: ZXEZATIRZLJXFU-UHFFFAOYSA-N PubChem CID: 140504 IUPAC Name: 1-chloro-3-isothiocyanato-2-methylbenzene SMILES: CC1=C(C=CC=C1Cl)N=C=S

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Specifications

PubChem CID	140504
CAS	19241-35-1
Molecular Weight (g/mol)	183.653
MDL Number	MFCD00022056
SMILES	CC1=C(C=CC=C1Cl)N=C=S
IUPAC Name	1-chloro-3-isothiocyanato-2-methylbenzene
InChI Key	ZXEZATIRZLJXFU-UHFFFAOYSA-N
Molecular Formula	C8H6ClNS

Chlorobenzene, ReagentPlus™, 99%, Solstice

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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3-Chloro-2-fluoroaniline, 97%

CAS: 2106-04-9 MDL Number: MFCD00069415

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Specifications

CAS	2106-04-9
MDL Number	MFCD00069415

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4-(4-Chlorophenyl)-1,2,3,6-tetrahydropyridine hydrochloride, 97%

CAS: 51304-61-1 MDL Number: MFCD00012753 InChI Key: NGDJUNABWNTULX-UHFFFAOYSA-N Synonym: 4-4-chlorophenyl-1,2,3,6-tetrahydropyridine hydrochloride,4-4-chlorophenyl-1,2,3,6-tetrahydropyridinium chloride,4-4-chlorophenyl-1,2,5,6-tetrahydropyridine, chloride,acmc-1alu0,4-4-chlorophenyl-1,2,3,6-tetrahydropyridine hcl,4-4-chloro-phenyl-1,2,3,6-tetrahydro-pyridine hydrochloride,4-4-chlorophenyl-1?2?3?6-tetrahydropyridine hydrochloride,4-4-chlorophenyl-1,2,3,6-tetrahydropyridine monohydrochloride,pyridine, 4-4-chlorophenyl-1,2,3,6-tetrahydro-, hydrochloride PubChem CID: 2723612 IUPAC Name: 4-(4-chlorophenyl)-1,2,3,6-tetrahydropyridine;hydrochloride SMILES: C1CNCC=C1C2=CC=C(C=C2)Cl.Cl

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Specifications

PubChem CID	2723612
CAS	51304-61-1
MDL Number	MFCD00012753
SMILES	C1CNCC=C1C2=CC=C(C=C2)Cl.Cl
Synonym	4-4-chlorophenyl-1,2,3,6-tetrahydropyridine hydrochloride,4-4-chlorophenyl-1,2,3,6-tetrahydropyridinium chloride,4-4-chlorophenyl-1,2,5,6-tetrahydropyridine, chloride,acmc-1alu0,4-4-chlorophenyl-1,2,3,6-tetrahydropyridine hcl,4-4-chloro-phenyl-1,2,3,6-tetrahydro-pyridine hydrochloride,4-4-chlorophenyl-1?2?3?6-tetrahydropyridine hydrochloride,4-4-chlorophenyl-1,2,3,6-tetrahydropyridine monohydrochloride,pyridine, 4-4-chlorophenyl-1,2,3,6-tetrahydro-, hydrochloride
IUPAC Name	4-(4-chlorophenyl)-1,2,3,6-tetrahydropyridine;hydrochloride
InChI Key	NGDJUNABWNTULX-UHFFFAOYSA-N

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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

(2-Chlorophenyl)methanesulfonyl chloride, ≥97%, Thermo Scientific™

CAS: 77421-13-7 Molecular Formula: C7H6Cl2O2S Molecular Weight (g/mol): 225.08 MDL Number: MFCD04116369 InChI Key: CHPZYFXSICSCNY-UHFFFAOYSA-N Synonym: 2-chlorophenyl methanesulfonyl chloride,2-chloro-phenyl-methanesulfonyl chloride,chloro 2-chlorophenyl methyl sulfone,pubchem5500,acmc-1bfc0,2-chlorobenzylsulfonyl chloride,benzenemethanesulfonylchloride, 2-chloro,2-chloro-phenyl methanesulfonyl chloride,2-chlorophenyl methane-sulfonyl chloride PubChem CID: 2757801 IUPAC Name: (2-chlorophenyl)methanesulfonyl chloride SMILES: ClC1=CC=CC=C1CS(Cl)(=O)=O

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Specifications

PubChem CID	2757801
CAS	77421-13-7
Molecular Weight (g/mol)	225.08
MDL Number	MFCD04116369
SMILES	ClC1=CC=CC=C1CS(Cl)(=O)=O
Synonym	2-chlorophenyl methanesulfonyl chloride,2-chloro-phenyl-methanesulfonyl chloride,chloro 2-chlorophenyl methyl sulfone,pubchem5500,acmc-1bfc0,2-chlorobenzylsulfonyl chloride,benzenemethanesulfonylchloride, 2-chloro,2-chloro-phenyl methanesulfonyl chloride,2-chlorophenyl methane-sulfonyl chloride
IUPAC Name	(2-chlorophenyl)methanesulfonyl chloride
InChI Key	CHPZYFXSICSCNY-UHFFFAOYSA-N
Molecular Formula	C7H6Cl2O2S

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4-Amino-2-chlorobenzonitrile, 99%

CAS: 20925-27-3 Molecular Formula: C7H5ClN2 Molecular Weight (g/mol): 152.58 MDL Number: MFCD00035926 InChI Key: ZFBKYGFPUCUYIF-UHFFFAOYSA-N Synonym: 3-chloro-4-cyanoaniline,2-chloro-4-aminobenzonitrile,benzonitrile, 4-amino-2-chloro,4-amino-2-chloro-benzonitrile,4-amino-2-chlorobenzenecarbonitrile,pubchem4620,4-cyano-3-chloroaniline,acmc-1cfb7,3-chloro-4-cyanobenzenamine,ksc497i5p PubChem CID: 88728 IUPAC Name: 4-amino-2-chlorobenzonitrile SMILES: NC1=CC=C(C#N)C(Cl)=C1

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Specifications

PubChem CID	88728
CAS	20925-27-3
Molecular Weight (g/mol)	152.58
MDL Number	MFCD00035926
SMILES	NC1=CC=C(C#N)C(Cl)=C1
Synonym	3-chloro-4-cyanoaniline,2-chloro-4-aminobenzonitrile,benzonitrile, 4-amino-2-chloro,4-amino-2-chloro-benzonitrile,4-amino-2-chlorobenzenecarbonitrile,pubchem4620,4-cyano-3-chloroaniline,acmc-1cfb7,3-chloro-4-cyanobenzenamine,ksc497i5p
IUPAC Name	4-amino-2-chlorobenzonitrile
InChI Key	ZFBKYGFPUCUYIF-UHFFFAOYSA-N
Molecular Formula	C7H5ClN2

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Methyl 2-chlorophenylacetate, 98%

CAS: 57486-68-7 Molecular Formula: C₉H₉ClO₂ Molecular Weight (g/mol): 184.62 MDL Number: MFCD00137445 InChI Key: KHBWTRFWQROKJZ-UHFFFAOYSA-N PubChem CID: 93683 IUPAC Name: methyl 2-(2-chlorophenyl)acetate SMILES: COC(=O)CC1=CC=CC=C1Cl

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Specifications

PubChem CID	93683
CAS	57486-68-7
Molecular Weight (g/mol)	184.62
MDL Number	MFCD00137445
SMILES	COC(=O)CC1=CC=CC=C1Cl
IUPAC Name	methyl 2-(2-chlorophenyl)acetate
InChI Key	KHBWTRFWQROKJZ-UHFFFAOYSA-N
Molecular Formula	C₉H₉ClO₂

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4-Chlorophenoxyacetonitrile, 98%, Thermo Scientific Chemicals

CAS: 3598-13-8 Molecular Formula: C8H6ClNO Molecular Weight (g/mol): 167.59 MDL Number: MFCD00031535 InChI Key: YUGDKEWUYZXXRU-UHFFFAOYSA-N Synonym: 2-4-chlorophenoxy acetonitrile,4-chlorophenoxyacetonitrile,4-chlorophenoxy acetonitrile,4-chloro-phenoxy-acetonitrile,p-chlorophenoxyacetonitrile,1-chloro-4-cyanomethoxy benzene,acetonitrile, 4-chlorophenoxy,4-chloro-o-cyanomethylphenol,2-4-chlorophenoxy ethanenitrile,acmc-20aopp PubChem CID: 306444 IUPAC Name: 2-(4-chlorophenoxy)acetonitrile SMILES: ClC1=CC=C(OCC#N)C=C1

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Specifications

PubChem CID	306444
CAS	3598-13-8
Molecular Weight (g/mol)	167.59
MDL Number	MFCD00031535
SMILES	ClC1=CC=C(OCC#N)C=C1
Synonym	2-4-chlorophenoxy acetonitrile,4-chlorophenoxyacetonitrile,4-chlorophenoxy acetonitrile,4-chloro-phenoxy-acetonitrile,p-chlorophenoxyacetonitrile,1-chloro-4-cyanomethoxy benzene,acetonitrile, 4-chlorophenoxy,4-chloro-o-cyanomethylphenol,2-4-chlorophenoxy ethanenitrile,acmc-20aopp
IUPAC Name	2-(4-chlorophenoxy)acetonitrile
InChI Key	YUGDKEWUYZXXRU-UHFFFAOYSA-N
Molecular Formula	C8H6ClNO

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1-Bromo-3,4,5-trichlorobenzene, 98%

CAS: 21928-51-8 Molecular Formula: C6H2BrCl3 Molecular Weight (g/mol): 260.34 MDL Number: MFCD00155009 InChI Key: VZUMVBQMJFFYRM-UHFFFAOYSA-N Synonym: 3,4,5-trichlorobromobenzene,benzene, 5-bromo-1,2,3-trichloro,1-bromo-3,4,5-trichlorobenzene,1-bromo-3,4,5-trichloro-benzene,pubchem23062,acmc-209fpm,ksc497i6l,1,2,3-trichloro-5-bromobenzene PubChem CID: 4124400 IUPAC Name: 5-bromo-1,2,3-trichlorobenzene SMILES: ClC1=CC(Br)=CC(Cl)=C1Cl

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Specifications

PubChem CID	4124400
CAS	21928-51-8
Molecular Weight (g/mol)	260.34
MDL Number	MFCD00155009
SMILES	ClC1=CC(Br)=CC(Cl)=C1Cl
Synonym	3,4,5-trichlorobromobenzene,benzene, 5-bromo-1,2,3-trichloro,1-bromo-3,4,5-trichlorobenzene,1-bromo-3,4,5-trichloro-benzene,pubchem23062,acmc-209fpm,ksc497i6l,1,2,3-trichloro-5-bromobenzene
IUPAC Name	5-bromo-1,2,3-trichlorobenzene
InChI Key	VZUMVBQMJFFYRM-UHFFFAOYSA-N
Molecular Formula	C6H2BrCl3

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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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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

Chlorobenzene

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