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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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1,2,4-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

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

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

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
3

2-Chlorobenzonitrile, 98%

CAS: 873-32-5 Molecular Formula: C7H4ClN Molecular Weight (g/mol): 137.566 MDL Number: MFCD00001779 InChI Key: NHWQMJMIYICNBP-UHFFFAOYSA-N Synonym: benzonitrile, 2-chloro,o-chlorobenzonitrile,o-chlorocyanobenzene,o-cyanochlorobenzene,benzonitrile, o-chloro,o-chlorbenzonitril,chlorobenzonitrile,2-chloro-benzonitrile,nitril kyseliny o-chlorbenzoove,o-chlorbenzonitril czech PubChem CID: 13391 IUPAC Name: 2-chlorobenzonitrile SMILES: C1=CC=C(C(=C1)C#N)Cl

PubChem CID 13391
CAS 873-32-5
Molecular Weight (g/mol) 137.566
MDL Number MFCD00001779
SMILES C1=CC=C(C(=C1)C#N)Cl
Synonym benzonitrile, 2-chloro,o-chlorobenzonitrile,o-chlorocyanobenzene,o-cyanochlorobenzene,benzonitrile, o-chloro,o-chlorbenzonitril,chlorobenzonitrile,2-chloro-benzonitrile,nitril kyseliny o-chlorbenzoove,o-chlorbenzonitril czech
IUPAC Name 2-chlorobenzonitrile
InChI Key NHWQMJMIYICNBP-UHFFFAOYSA-N
Molecular Formula C7H4ClN
4

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
5

2-Chloro-6-methylphenyl isocyanate, 97%

CAS: 40398-01-4 Molecular Formula: C8H6ClNO Molecular Weight (g/mol): 167.592 MDL Number: MFCD00037030 InChI Key: FBTQQNYGMICJQZ-UHFFFAOYSA-N Synonym: 2-chloro-6-methylphenyl isocyanate,2-chloro-6-methylphenylisocyanate,benzene, 1-chloro-2-isocyanato-3-methyl,acmc-1ake5,2-chloro-6-methylbenzenisocyanate,2-chloro 6-methyl phenylisocyanate,2-chloro 6-methyl phenyl isocyanate,2-chloro-1-isocyanato-6-methyl benzene,1-chloro-2-isocyanato-3-methyl-benzene,6-chloro-2-methylphenylisocyanate PubChem CID: 268123 IUPAC Name: 1-chloro-2-isocyanato-3-methylbenzene SMILES: CC1=C(C(=CC=C1)Cl)N=C=O

PubChem CID 268123
CAS 40398-01-4
Molecular Weight (g/mol) 167.592
MDL Number MFCD00037030
SMILES CC1=C(C(=CC=C1)Cl)N=C=O
Synonym 2-chloro-6-methylphenyl isocyanate,2-chloro-6-methylphenylisocyanate,benzene, 1-chloro-2-isocyanato-3-methyl,acmc-1ake5,2-chloro-6-methylbenzenisocyanate,2-chloro 6-methyl phenylisocyanate,2-chloro 6-methyl phenyl isocyanate,2-chloro-1-isocyanato-6-methyl benzene,1-chloro-2-isocyanato-3-methyl-benzene,6-chloro-2-methylphenylisocyanate
IUPAC Name 1-chloro-2-isocyanato-3-methylbenzene
InChI Key FBTQQNYGMICJQZ-UHFFFAOYSA-N
Molecular Formula C8H6ClNO
6

3-Chloro-4-methylphenyl isocyanate, 98%

CAS: 28479-22-3 Molecular Formula: C8H6ClNO Molecular Weight (g/mol): 167.59 MDL Number: MFCD00013858 InChI Key: UKTKKMZDESVUEE-UHFFFAOYSA-N Synonym: 3-chloro-4-methylphenyl isocyanate,3-chloro-4-methylphenylisocyanate,benzene, 2-chloro-4-isocyanato-1-methyl,3-chloro-p-tolyl isocyanate,isocyanic acid 3-chloro-4-methylphenyl ester,3-chloro-4-methyl phenyl isocyanate,acmc-1ar7g,3-chlor-4-methylphenylisocyanat,2-chloro-4-isocyanato toluene,3-chloro-4-methylphenyl isocyanate un2236 poison PubChem CID: 62832 IUPAC Name: 2-chloro-4-isocyanato-1-methylbenzene SMILES: CC1=CC=C(C=C1Cl)N=C=O

PubChem CID 62832
CAS 28479-22-3
Molecular Weight (g/mol) 167.59
MDL Number MFCD00013858
SMILES CC1=CC=C(C=C1Cl)N=C=O
Synonym 3-chloro-4-methylphenyl isocyanate,3-chloro-4-methylphenylisocyanate,benzene, 2-chloro-4-isocyanato-1-methyl,3-chloro-p-tolyl isocyanate,isocyanic acid 3-chloro-4-methylphenyl ester,3-chloro-4-methyl phenyl isocyanate,acmc-1ar7g,3-chlor-4-methylphenylisocyanat,2-chloro-4-isocyanato toluene,3-chloro-4-methylphenyl isocyanate un2236 poison
IUPAC Name 2-chloro-4-isocyanato-1-methylbenzene
InChI Key UKTKKMZDESVUEE-UHFFFAOYSA-N
Molecular Formula C8H6ClNO
7

3-Chlorophenyl isothiocyanate, 97%

CAS: 2392-68-9 Molecular Formula: C7H4ClNS Molecular Weight (g/mol): 169.63 MDL Number: MFCD00004805 InChI Key: WGXCKFMVBAOIFH-UHFFFAOYSA-N Synonym: 3-chlorophenyl isothiocyanate,3-chlorophenylisothiocyanate,benzene, 1-chloro-3-isothiocyanato,isothiocyanic acid, 3-chlorophenyl ester,isothiocyanic acid, m-chlorophenyl ester,m-chlorophenyl isothiocyanate,1-chloro-3-isothiocyanato-benzene,3-chlorobenzenisothiocyanate,wln: scnr cg,acmc-1cfb8 PubChem CID: 75449 IUPAC Name: 1-chloro-3-isothiocyanatobenzene SMILES: ClC1=CC=CC(=C1)N=C=S

PubChem CID 75449
CAS 2392-68-9
Molecular Weight (g/mol) 169.63
MDL Number MFCD00004805
SMILES ClC1=CC=CC(=C1)N=C=S
Synonym 3-chlorophenyl isothiocyanate,3-chlorophenylisothiocyanate,benzene, 1-chloro-3-isothiocyanato,isothiocyanic acid, 3-chlorophenyl ester,isothiocyanic acid, m-chlorophenyl ester,m-chlorophenyl isothiocyanate,1-chloro-3-isothiocyanato-benzene,3-chlorobenzenisothiocyanate,wln: scnr cg,acmc-1cfb8
IUPAC Name 1-chloro-3-isothiocyanatobenzene
InChI Key WGXCKFMVBAOIFH-UHFFFAOYSA-N
Molecular Formula C7H4ClNS
8

3-Chloroaniline, 99%

CAS: 108-42-9 Molecular Formula: C6H6ClN Molecular Weight (g/mol): 127.57 MDL Number: MFCD00007765 InChI Key: PNPCRKVUWYDDST-UHFFFAOYSA-N Synonym: m-chloroaniline,3-chlorobenzenamine,benzenamine, 3-chloro,m-chloraniline,3-chlorophenylamine,orange gc base,m-chlorophenylamine,m-aminochlorobenzene,m-chloroaminobenzene,aniline, m-chloro PubChem CID: 7932 IUPAC Name: 3-chloroaniline SMILES: NC1=CC=CC(Cl)=C1

PubChem CID 7932
CAS 108-42-9
Molecular Weight (g/mol) 127.57
MDL Number MFCD00007765
SMILES NC1=CC=CC(Cl)=C1
Synonym m-chloroaniline,3-chlorobenzenamine,benzenamine, 3-chloro,m-chloraniline,3-chlorophenylamine,orange gc base,m-chlorophenylamine,m-aminochlorobenzene,m-chloroaminobenzene,aniline, m-chloro
IUPAC Name 3-chloroaniline
InChI Key PNPCRKVUWYDDST-UHFFFAOYSA-N
Molecular Formula C6H6ClN
9

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

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
10

4-Amino-3-chlorobenzonitrile, 98%

CAS: 21803-75-8 Molecular Formula: C7H5ClN2 Molecular Weight (g/mol): 152.58 MDL Number: MFCD00052917 InChI Key: OREVCMGFYSUYPX-UHFFFAOYSA-N Synonym: 3-chloro-4-aminobenzonitrile,2-chloro-4-cyanoaniline,3-chloro-4-aminbenzonitrile,4-amino-3-chloro-benzonitrile,benzonitrile, 4-amino-3-chloro,4-amino-3-chlorobenzenecarbonitrile,pubchem4625,2-chloro-4-cyanoanilin,2-chloro-4-cyano-aniline,acmc-1cs04 PubChem CID: 519896 IUPAC Name: 4-amino-3-chlorobenzonitrile SMILES: NC1=CC=C(C=C1Cl)C#N

PubChem CID 519896
CAS 21803-75-8
Molecular Weight (g/mol) 152.58
MDL Number MFCD00052917
SMILES NC1=CC=C(C=C1Cl)C#N
Synonym 3-chloro-4-aminobenzonitrile,2-chloro-4-cyanoaniline,3-chloro-4-aminbenzonitrile,4-amino-3-chloro-benzonitrile,benzonitrile, 4-amino-3-chloro,4-amino-3-chlorobenzenecarbonitrile,pubchem4625,2-chloro-4-cyanoanilin,2-chloro-4-cyano-aniline,acmc-1cs04
IUPAC Name 4-amino-3-chlorobenzonitrile
InChI Key OREVCMGFYSUYPX-UHFFFAOYSA-N
Molecular Formula C7H5ClN2
11

5-Bromo-2-chlorotoluene, 98%

CAS: 54932-72-8 Molecular Formula: C7H6BrCl Molecular Weight (g/mol): 205.479 MDL Number: MFCD00018503 InChI Key: OZFQMHJKAODEON-UHFFFAOYSA-N Synonym: 5-bromo-2-chlorotoluene,benzene, 4-bromo-1-chloro-2-methyl,2-chloro-5-bromotoluene,pubchem3604,5-bromo-2-chlorotoulene,acmc-209lk8,ksc493o2d,ozfqmhjkaodeon-uhfffaoysa,attercop-chm at115283 PubChem CID: 609899 IUPAC Name: 4-bromo-1-chloro-2-methylbenzene SMILES: CC1=C(C=CC(=C1)Br)Cl

PubChem CID 609899
CAS 54932-72-8
Molecular Weight (g/mol) 205.479
MDL Number MFCD00018503
SMILES CC1=C(C=CC(=C1)Br)Cl
Synonym 5-bromo-2-chlorotoluene,benzene, 4-bromo-1-chloro-2-methyl,2-chloro-5-bromotoluene,pubchem3604,5-bromo-2-chlorotoulene,acmc-209lk8,ksc493o2d,ozfqmhjkaodeon-uhfffaoysa,attercop-chm at115283
IUPAC Name 4-bromo-1-chloro-2-methylbenzene
InChI Key OZFQMHJKAODEON-UHFFFAOYSA-N
Molecular Formula C7H6BrCl
12

4-Chlorobenzamidine hydriodide, 96%

CAS: 115297-57-9 Molecular Formula: C7H8ClIN2 Molecular Weight (g/mol): 282.509 MDL Number: MFCD00051987 InChI Key: YMEVGWRZEYGNJO-UHFFFAOYSA-N Synonym: 4-chlorobenzamidine hydroiodide,4-chlorobenzimidamide hydroiodide,4-chlorobenzamidine hydriodide,chlorophenamidine hydroiodide,4-chlorobenzenecarboximidamide hydroiodide,acmc-1bu33,benzenecarboximidamide,4-chloro-,hydriodide 1:1,benzenecarboximidamide,4-chloro-, hydriodide 1:1 PubChem CID: 2734221 IUPAC Name: 4-chlorobenzenecarboximidamide;hydroiodide SMILES: C1=CC(=CC=C1C(=N)N)Cl.I

PubChem CID 2734221
CAS 115297-57-9
Molecular Weight (g/mol) 282.509
MDL Number MFCD00051987
SMILES C1=CC(=CC=C1C(=N)N)Cl.I
Synonym 4-chlorobenzamidine hydroiodide,4-chlorobenzimidamide hydroiodide,4-chlorobenzamidine hydriodide,chlorophenamidine hydroiodide,4-chlorobenzenecarboximidamide hydroiodide,acmc-1bu33,benzenecarboximidamide,4-chloro-,hydriodide 1:1,benzenecarboximidamide,4-chloro-, hydriodide 1:1
IUPAC Name 4-chlorobenzenecarboximidamide;hydroiodide
InChI Key YMEVGWRZEYGNJO-UHFFFAOYSA-N
Molecular Formula C7H8ClIN2
13

2,3,5-Trichlorobenzeneboronic acid, 98%

CAS: 212779-19-6 Molecular Formula: C6H4BCl3O2 Molecular Weight (g/mol): 225.26 MDL Number: MFCD01630856 InChI Key: OPBCCRZCYTUJMS-UHFFFAOYSA-N Synonym: 2,3,5-trichlorobenzeneboronic acid,2,3,5-trichlorophenyl boronic acid,boronic acid, b-2,3,5-trichlorophenyl,b-2,3,5-trichlorophenyl-boronic acid,pubchem14112,acmc-209fiq,2,3,5-trichlorophenylboronicacid,2,3,5-trichlorobenzene boronic acid,2,3,5-trichloro-phenyl boronic acid,boronic acid, 2,3,5-trichlorophenyl PubChem CID: 5106508 IUPAC Name: (2,3,5-trichlorophenyl)boronic acid SMILES: OB(O)C1=CC(Cl)=CC(Cl)=C1Cl

PubChem CID 5106508
CAS 212779-19-6
Molecular Weight (g/mol) 225.26
MDL Number MFCD01630856
SMILES OB(O)C1=CC(Cl)=CC(Cl)=C1Cl
Synonym 2,3,5-trichlorobenzeneboronic acid,2,3,5-trichlorophenyl boronic acid,boronic acid, b-2,3,5-trichlorophenyl,b-2,3,5-trichlorophenyl-boronic acid,pubchem14112,acmc-209fiq,2,3,5-trichlorophenylboronicacid,2,3,5-trichlorobenzene boronic acid,2,3,5-trichloro-phenyl boronic acid,boronic acid, 2,3,5-trichlorophenyl
IUPAC Name (2,3,5-trichlorophenyl)boronic acid
InChI Key OPBCCRZCYTUJMS-UHFFFAOYSA-N
Molecular Formula C6H4BCl3O2
14

4-Chlorophenyl isothiocyanate, 98%

CAS: 2131-55-7 Molecular Formula: C7H4ClNS Molecular Weight (g/mol): 169.626 MDL Number: MFCD00004810 InChI Key: MZZVFXMTZTVUFO-UHFFFAOYSA-N PubChem CID: 16480 IUPAC Name: 1-chloro-4-isothiocyanatobenzene SMILES: C1=CC(=CC=C1N=C=S)Cl

PubChem CID 16480
CAS 2131-55-7
Molecular Weight (g/mol) 169.626
MDL Number MFCD00004810
SMILES C1=CC(=CC=C1N=C=S)Cl
IUPAC Name 1-chloro-4-isothiocyanatobenzene
InChI Key MZZVFXMTZTVUFO-UHFFFAOYSA-N
Molecular Formula C7H4ClNS
15

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

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