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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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1

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

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

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
2

2-Chlorophenyl isothiocyanate, 97%

CAS: 2740-81-0 Molecular Formula: C7H4ClNS Molecular Weight (g/mol): 169.626 MDL Number: MFCD00004801 InChI Key: DASSPOJBUMBXLU-UHFFFAOYSA-N Synonym: 2-chlorophenyl isothiocyanate,2-chlorophenylisothiocyanate,benzene, 1-chloro-2-isothiocyanato,benzene, chloroisothiocyanato,1-chloro-2-isothiocyanato-benzene,isothiocyanic acid 2-chlorophenyl ester,2-chlorobenzenisothiocyanate,acmc-1ccw5,o-chlorophenylisothiocyanate,o-chlorophenyl isothiocyanate PubChem CID: 123171 IUPAC Name: 1-chloro-2-isothiocyanatobenzene SMILES: C1=CC=C(C(=C1)N=C=S)Cl

PubChem CID 123171
CAS 2740-81-0
Molecular Weight (g/mol) 169.626
MDL Number MFCD00004801
SMILES C1=CC=C(C(=C1)N=C=S)Cl
Synonym 2-chlorophenyl isothiocyanate,2-chlorophenylisothiocyanate,benzene, 1-chloro-2-isothiocyanato,benzene, chloroisothiocyanato,1-chloro-2-isothiocyanato-benzene,isothiocyanic acid 2-chlorophenyl ester,2-chlorobenzenisothiocyanate,acmc-1ccw5,o-chlorophenylisothiocyanate,o-chlorophenyl isothiocyanate
IUPAC Name 1-chloro-2-isothiocyanatobenzene
InChI Key DASSPOJBUMBXLU-UHFFFAOYSA-N
Molecular Formula C7H4ClNS
3

Chlorobenzene, Spectrophotometric Grade, 99.9%

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

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
4

4-Chlorobenzenesulfinic acid sodium salt hydrate, 97%

CAS: 14752-66-0 Molecular Formula: C6H4ClNaO2S Molecular Weight (g/mol): 198.60 MDL Number: MFCD00035602 InChI Key: JFXAUUFCZJYLJF-UHFFFAOYSA-M Synonym: sodium 4-chlorobenzenesulfinate,4-chlorobenzenesulfinic acid sodium salt,sodium 4-chlorobenzene sulfinate,unii-x2u129fz4n,sodium p-chlorobenzenesulphinate,sodium 4-chlorobenzene-1-sulfinate,4-chlorobenzene sulfinic acid sodium,4-chlorobenzenesulfinic acid sodium salt hydrate,p-chlorobenzenesulfinic acid, sodium salt,acmc-1cin1 PubChem CID: 23664783 IUPAC Name: sodium;4-chlorobenzenesulfinate SMILES: [Na+].[O-]S(=O)C1=CC=C(Cl)C=C1

PubChem CID 23664783
CAS 14752-66-0
Molecular Weight (g/mol) 198.60
MDL Number MFCD00035602
SMILES [Na+].[O-]S(=O)C1=CC=C(Cl)C=C1
Synonym sodium 4-chlorobenzenesulfinate,4-chlorobenzenesulfinic acid sodium salt,sodium 4-chlorobenzene sulfinate,unii-x2u129fz4n,sodium p-chlorobenzenesulphinate,sodium 4-chlorobenzene-1-sulfinate,4-chlorobenzene sulfinic acid sodium,4-chlorobenzenesulfinic acid sodium salt hydrate,p-chlorobenzenesulfinic acid, sodium salt,acmc-1cin1
IUPAC Name sodium;4-chlorobenzenesulfinate
InChI Key JFXAUUFCZJYLJF-UHFFFAOYSA-M
Molecular Formula C6H4ClNaO2S
5

Chlorobenzene, ACS, 99.5%

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

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
6

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

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
7

1,2,4-Trichlorobenzene, 99%

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

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
8

3-(4-Chlorophenoxy)-1,2-propanediol, 99%

CAS: 104-29-0 Molecular Formula: C9H11ClO3 Molecular Weight (g/mol): 202.634 MDL Number: MFCD00021990 InChI Key: MXOAEAUPQDYUQM-UHFFFAOYSA-N Synonym: chlorphenesin,3-4-chlorophenoxy-1,2-propanediol,3-4-chlorophenoxy propane-1,2-diol,chlorophenesin,chlorphenesinum,adermykon,gecophen,demykon,mycil,chlorphenesine PubChem CID: 7697 ChEBI: CHEBI:3642 IUPAC Name: 3-(4-chlorophenoxy)propane-1,2-diol SMILES: C1=CC(=CC=C1OCC(CO)O)Cl

PubChem CID 7697
CAS 104-29-0
Molecular Weight (g/mol) 202.634
ChEBI CHEBI:3642
MDL Number MFCD00021990
SMILES C1=CC(=CC=C1OCC(CO)O)Cl
Synonym chlorphenesin,3-4-chlorophenoxy-1,2-propanediol,3-4-chlorophenoxy propane-1,2-diol,chlorophenesin,chlorphenesinum,adermykon,gecophen,demykon,mycil,chlorphenesine
IUPAC Name 3-(4-chlorophenoxy)propane-1,2-diol
InChI Key MXOAEAUPQDYUQM-UHFFFAOYSA-N
Molecular Formula C9H11ClO3
9

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

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
10

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

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
11

2-Chlorobenzeneboronic acid, 97%

CAS: 3900-89-8 Molecular Formula: C6H6BClO2 Molecular Weight (g/mol): 156.37 MDL Number: MFCD00674012 InChI Key: RRCMGJCFMJBHQC-UHFFFAOYSA-N Synonym: 2-chlorophenyl boronic acid,2-chlorobenzeneboronic acid,2-chlorophenylboronicacid,2-chlorophenylbornic acid,o-chlorophenylboronic acid,2-chlorophenyl boranediol,boronic acid, 2-chlorophenyl,2-chloro-phenyl-boronic acid,boronic acid, b-2-chlorophenyl PubChem CID: 2734322 IUPAC Name: (2-chlorophenyl)boronic acid SMILES: OB(O)C1=CC=CC=C1Cl

PubChem CID 2734322
CAS 3900-89-8
Molecular Weight (g/mol) 156.37
MDL Number MFCD00674012
SMILES OB(O)C1=CC=CC=C1Cl
Synonym 2-chlorophenyl boronic acid,2-chlorobenzeneboronic acid,2-chlorophenylboronicacid,2-chlorophenylbornic acid,o-chlorophenylboronic acid,2-chlorophenyl boranediol,boronic acid, 2-chlorophenyl,2-chloro-phenyl-boronic acid,boronic acid, b-2-chlorophenyl
IUPAC Name (2-chlorophenyl)boronic acid
InChI Key RRCMGJCFMJBHQC-UHFFFAOYSA-N
Molecular Formula C6H6BClO2
12

3-Chlorophenylacetic acid, 98+%

CAS: 1878-65-5 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00004332 InChI Key: WFPMUFXQDKMVCO-UHFFFAOYSA-N Synonym: 3-chlorophenylacetic acid,m-chlorophenylacetic acid,2-3-chlorophenyl acetic acid,3-chlorobenzeneacetic acid,benzeneacetic acid, 3-chloro,m-chlorophenyl acetic acid,3-chlorophenyl acetic acid,3-chlorophenylaceticacid,acetic acid, m-chlorophenyl PubChem CID: 15879 IUPAC Name: 2-(3-chlorophenyl)acetic acid SMILES: OC(=O)CC1=CC=CC(Cl)=C1

PubChem CID 15879
CAS 1878-65-5
Molecular Weight (g/mol) 170.59
MDL Number MFCD00004332
SMILES OC(=O)CC1=CC=CC(Cl)=C1
Synonym 3-chlorophenylacetic acid,m-chlorophenylacetic acid,2-3-chlorophenyl acetic acid,3-chlorobenzeneacetic acid,benzeneacetic acid, 3-chloro,m-chlorophenyl acetic acid,3-chlorophenyl acetic acid,3-chlorophenylaceticacid,acetic acid, m-chlorophenyl
IUPAC Name 2-(3-chlorophenyl)acetic acid
InChI Key WFPMUFXQDKMVCO-UHFFFAOYSA-N
Molecular Formula C8H7ClO2
13

4-Chlorobenzonitrile, 99%

CAS: 623-03-0 Molecular Formula: C7H4ClN Molecular Weight (g/mol): 137.57 MDL Number: MFCD00001813 InChI Key: GJNGXPDXRVXSEH-UHFFFAOYSA-N Synonym: p-chlorobenzonitrile,benzonitrile, 4-chloro,p-cyanochlorobenzene,benzonitrile, p-chloro,4-cyanochlorobenzene,nitril kyseliny p-chlorbenzoove,p-chlorbenzonitrile,unii-4z0hgp3a8a,pcbn,4-chloro benzonitrile PubChem CID: 12163 IUPAC Name: 4-chlorobenzonitrile SMILES: ClC1=CC=C(C=C1)C#N

PubChem CID 12163
CAS 623-03-0
Molecular Weight (g/mol) 137.57
MDL Number MFCD00001813
SMILES ClC1=CC=C(C=C1)C#N
Synonym p-chlorobenzonitrile,benzonitrile, 4-chloro,p-cyanochlorobenzene,benzonitrile, p-chloro,4-cyanochlorobenzene,nitril kyseliny p-chlorbenzoove,p-chlorbenzonitrile,unii-4z0hgp3a8a,pcbn,4-chloro benzonitrile
IUPAC Name 4-chlorobenzonitrile
InChI Key GJNGXPDXRVXSEH-UHFFFAOYSA-N
Molecular Formula C7H4ClN
14

4-Chloro-o-phenylenediamine, 97%

CAS: 95-83-0 Molecular Formula: C6H7ClN2 Molecular Weight (g/mol): 142.59 MDL Number: MFCD00011691 InChI Key: BXIXXXYDDJVHDL-UHFFFAOYSA-N Synonym: 4-chloro-1,2-diaminobenzene,4-chloro-o-phenylenediamine,4-chloro-1,2-phenylenediamine,1,2-diamino-4-chlorobenzene,1,2-benzenediamine, 4-chloro,ursol olive 6g,3,4-diaminochlorobenzene,4-chloro-1,2-benzenediamine,2-amino-4-chloroaniline,p-chloro-o-phenylenediamine PubChem CID: 7263 ChEBI: CHEBI:82301 IUPAC Name: 4-chlorobenzene-1,2-diamine SMILES: NC1=CC=C(Cl)C=C1N

PubChem CID 7263
CAS 95-83-0
Molecular Weight (g/mol) 142.59
ChEBI CHEBI:82301
MDL Number MFCD00011691
SMILES NC1=CC=C(Cl)C=C1N
Synonym 4-chloro-1,2-diaminobenzene,4-chloro-o-phenylenediamine,4-chloro-1,2-phenylenediamine,1,2-diamino-4-chlorobenzene,1,2-benzenediamine, 4-chloro,ursol olive 6g,3,4-diaminochlorobenzene,4-chloro-1,2-benzenediamine,2-amino-4-chloroaniline,p-chloro-o-phenylenediamine
IUPAC Name 4-chlorobenzene-1,2-diamine
InChI Key BXIXXXYDDJVHDL-UHFFFAOYSA-N
Molecular Formula C6H7ClN2
15

4-Chlorotoluene, 98%

CAS: 106-43-4 Molecular Formula: C7H7Cl Molecular Weight (g/mol): 126.58 MDL Number: MFCD00000631 InChI Key: NPDACUSDTOMAMK-UHFFFAOYSA-N Synonym: 4-chlorotoluene,p-chlorotoluene,benzene, 1-chloro-4-methyl,p-tolyl chloride,toluene, p-chloro,1-methyl-4-chlorobenzene,4-chloro-1-methylbenzene,monochlorotoluene,para-chlorotoluene,unii-q8r236h42n PubChem CID: 7810 ChEBI: CHEBI:34401 IUPAC Name: 1-chloro-4-methylbenzene SMILES: CC1=CC=C(Cl)C=C1

PubChem CID 7810
CAS 106-43-4
Molecular Weight (g/mol) 126.58
ChEBI CHEBI:34401
MDL Number MFCD00000631
SMILES CC1=CC=C(Cl)C=C1
Synonym 4-chlorotoluene,p-chlorotoluene,benzene, 1-chloro-4-methyl,p-tolyl chloride,toluene, p-chloro,1-methyl-4-chlorobenzene,4-chloro-1-methylbenzene,monochlorotoluene,para-chlorotoluene,unii-q8r236h42n
IUPAC Name 1-chloro-4-methylbenzene
InChI Key NPDACUSDTOMAMK-UHFFFAOYSA-N
Molecular Formula C7H7Cl