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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

Chlorobenzene (Laboratory), Fisher Chemical™

CAS: 108-90-7 Formule moléculaire: C6H5Cl Poids moléculaire (g/mol): 112.556 Numéro MDL: MFCD00000530 Clé InChI: MVPPADPHJFYWMZ-UHFFFAOYSA-N Synonyme: monochlorobenzene,benzene chloride,phenyl chloride,benzene, chloro,chlorbenzene,chlorobenzol,monochlorbenzol,chlorbenzol,chlorobenzen,clorobenzene CID PubChem: 7964 ChEBI: CHEBI:28097 Nom IUPAC: chlorobenzene SMILES: C1=CC=C(C=C1)Cl

Poids moléculaire (g/mol) 112.556
Synonyme monochlorobenzene,benzene chloride,phenyl chloride,benzene, chloro,chlorbenzene,chlorobenzol,monochlorbenzol,chlorbenzol,chlorobenzen,clorobenzene
Numéro MDL MFCD00000530
CAS 108-90-7
CID PubChem 7964
ChEBI CHEBI:28097
Nom IUPAC chlorobenzene
Clé InChI MVPPADPHJFYWMZ-UHFFFAOYSA-N
SMILES C1=CC=C(C=C1)Cl
Formule moléculaire C6H5Cl
2
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1,2,4-Trichlorobenzene (HPLC), Fisher Chemical

CAS: 120-82-1 Formule moléculaire: C6H3Cl3 Poids moléculaire (g/mol): 181.44 Numéro MDL: MFCD00000547 Clé InChI: PBKONEOXTCPAFI-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 13 ChEBI: CHEBI:28222 Nom IUPAC: 1,2,4-trichlorobenzene SMILES: C1=CC(=C(C=C1Cl)Cl)Cl

Poids moléculaire (g/mol) 181.44
Synonyme 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
Numéro MDL MFCD00000547
CAS 120-82-1
CID PubChem 13
ChEBI CHEBI:28222
Nom IUPAC 1,2,4-trichlorobenzene
Clé InChI PBKONEOXTCPAFI-UHFFFAOYSA-N
SMILES C1=CC(=C(C=C1Cl)Cl)Cl
Formule moléculaire C6H3Cl3
3

3-chloro-5-fluoroaniline, 97%

CAS: 4863-91-6 Formule moléculaire: C6H5ClFN Poids moléculaire (g/mol): 145.56 Numéro MDL: MFCD03407962 Clé InChI: LPIFAHAICWJMRR-UHFFFAOYSA-N Synonyme: pubchem2953,acmc-209kdj,3-chloro-5-fluorobenzenamine,5-chloro-3-fluorophenylamine,ksc493m9f,3-chloro-5-fluoro-phenylamine,buttpark 44\01-96 CID PubChem: 2734838 Nom IUPAC: 3-chloro-5-fluoroaniline SMILES: C1=C(C=C(C=C1F)Cl)N

Poids moléculaire (g/mol) 145.56
Synonyme pubchem2953,acmc-209kdj,3-chloro-5-fluorobenzenamine,5-chloro-3-fluorophenylamine,ksc493m9f,3-chloro-5-fluoro-phenylamine,buttpark 44\01-96
Numéro MDL MFCD03407962
CAS 4863-91-6
CID PubChem 2734838
Nom IUPAC 3-chloro-5-fluoroaniline
Clé InChI LPIFAHAICWJMRR-UHFFFAOYSA-N
SMILES C1=C(C=C(C=C1F)Cl)N
Formule moléculaire C6H5ClFN
4

2-Chlorophenylacetic acid, 98.5+%

CAS: 2444-36-2 Formule moléculaire: C8H7ClO2 Poids moléculaire (g/mol): 170.6 Numéro MDL: MFCD00004317 Clé InChI: IUJAAIZKRJJZGQ-UHFFFAOYSA-N Synonyme: 2-chlorophenylacetic acid,o-chlorophenylacetic acid,2-2-chlorophenyl acetic acid,2-chlorophenyl acetic acid,2-chlorophenylaceticacid,benzeneacetic acid, 2-chloro,o-chlorophenyl acetic acid,acetic acid, o-chlorophenyl,2-chloro-benzeneacetic acid CID PubChem: 17124 Nom IUPAC: 2-(2-chlorophenyl)acetic acid SMILES: C1=CC=C(C(=C1)CC(=O)O)Cl

Poids moléculaire (g/mol) 170.6
Synonyme 2-chlorophenylacetic acid,o-chlorophenylacetic acid,2-2-chlorophenyl acetic acid,2-chlorophenyl acetic acid,2-chlorophenylaceticacid,benzeneacetic acid, 2-chloro,o-chlorophenyl acetic acid,acetic acid, o-chlorophenyl,2-chloro-benzeneacetic acid
Numéro MDL MFCD00004317
CAS 2444-36-2
CID PubChem 17124
Nom IUPAC 2-(2-chlorophenyl)acetic acid
Clé InChI IUJAAIZKRJJZGQ-UHFFFAOYSA-N
SMILES C1=CC=C(C(=C1)CC(=O)O)Cl
Formule moléculaire C8H7ClO2
5

(R)-1-(4-Chlorophenyl)ethylamine, 97%, 98% ee

CAS: 27298-99-3 Formule moléculaire: C8H10ClN Poids moléculaire (g/mol): 155.63 Numéro MDL: MFCD00671639 Clé InChI: PINPOEWMCLFRRB-ZCFIWIBFSA-N Synonyme: 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 CID PubChem: 1715226 Nom IUPAC: (1R)-1-(4-chlorophenyl)ethanamine SMILES: CC(C1=CC=C(C=C1)Cl)N

Poids moléculaire (g/mol) 155.63
Synonyme 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
Numéro MDL MFCD00671639
CAS 27298-99-3
CID PubChem 1715226
Nom IUPAC (1R)-1-(4-chlorophenyl)ethanamine
Clé InChI PINPOEWMCLFRRB-ZCFIWIBFSA-N
SMILES CC(C1=CC=C(C=C1)Cl)N
Formule moléculaire C8H10ClN
6

2-chlorophenylacetyl Chloride, 97%

CAS: 51512-09-5 Formule moléculaire: C8H6Cl2O Poids moléculaire (g/mol): 189.04 Numéro MDL: MFCD00130223 Clé InChI: WIHSAOYVGKVRJX-UHFFFAOYSA-N Synonyme: 2-chlorophenylacetyl chloride,2-2-chlorophenyl acetyl chloride,acetyl chloride, 2-2-chlorophenyl,o-chlorophenylacetyl chloride,benzeneacetyl chloride, 2-chloro,2-chlorophenylacetyl chloride stabilized with copper chip,acmc-1auqq,o-chlor-phenylacetylchlorid,o-chloro-phenylacetyl chloride,2-chloro-phenylacetyl chloride CID PubChem: 182669 Nom IUPAC: 2-(2-chlorophenyl)acetyl chloride SMILES: ClC(=O)CC1=CC=CC=C1Cl

Poids moléculaire (g/mol) 189.04
Synonyme 2-chlorophenylacetyl chloride,2-2-chlorophenyl acetyl chloride,acetyl chloride, 2-2-chlorophenyl,o-chlorophenylacetyl chloride,benzeneacetyl chloride, 2-chloro,2-chlorophenylacetyl chloride stabilized with copper chip,acmc-1auqq,o-chlor-phenylacetylchlorid,o-chloro-phenylacetyl chloride,2-chloro-phenylacetyl chloride
Numéro MDL MFCD00130223
CAS 51512-09-5
CID PubChem 182669
Nom IUPAC 2-(2-chlorophenyl)acetyl chloride
Clé InChI WIHSAOYVGKVRJX-UHFFFAOYSA-N
SMILES ClC(=O)CC1=CC=CC=C1Cl
Formule moléculaire C8H6Cl2O
7

Ethyl 4-chlorophenylacetate, 98+%

CAS: 14062-24-9 Numéro MDL: MFCD00018791 Clé InChI: UTWBWFXECVFDPZ-UHFFFAOYSA-N Synonyme: ethyl 4-chlorophenylacetate,ethyl 4-chlorophenyl acetate,ethyl 2-4-chlorophenyl acetate,4-chlorophenyl acetic acid ethyl ester,ethyl p-chlorophenylacetate,benzeneacetic acid, 4-chloro-, ethyl ester,4-chloro-phenyl-acetic acid ethyl ester,ethyl 4-chloro-phenylacetate,ksc522e5p CID PubChem: 84177 Nom IUPAC: ethyl 2-(4-chlorophenyl)acetate SMILES: CCOC(=O)CC1=CC=C(C=C1)Cl

Synonyme ethyl 4-chlorophenylacetate,ethyl 4-chlorophenyl acetate,ethyl 2-4-chlorophenyl acetate,4-chlorophenyl acetic acid ethyl ester,ethyl p-chlorophenylacetate,benzeneacetic acid, 4-chloro-, ethyl ester,4-chloro-phenyl-acetic acid ethyl ester,ethyl 4-chloro-phenylacetate,ksc522e5p
Numéro MDL MFCD00018791
CAS 14062-24-9
CID PubChem 84177
Nom IUPAC ethyl 2-(4-chlorophenyl)acetate
Clé InChI UTWBWFXECVFDPZ-UHFFFAOYSA-N
SMILES CCOC(=O)CC1=CC=C(C=C1)Cl
8

1-(4-Chlorophenyl)-1-cyclopentanecarboxylic acid, 98%, Thermo Scientific™

CAS: 80789-69-1 Formule moléculaire: C12H13ClO2 Poids moléculaire (g/mol): 224.69 Numéro MDL: MFCD00001373 Clé InChI: QJNFJEMGWIQMJT-UHFFFAOYSA-N Synonyme: 1-4-chlorophenyl cyclopentanecarboxylic acid,1-4-chlorophenyl-1-cyclopentanecarboxylic acid,1-4-chlorophenyl cyclopentane-1-carboxylic acid,cyclopentanecarboxylic acid, 1-4-chlorophenyl,asischem d50961,timtec-bb sbb000649,acmc-209pk2,labotest-bb lt00453384,1-4-chloro phenyl cyclopentanecarboxylic acid,1-4-chloro-phenyl-cyclopentylcarboxylic acid CID PubChem: 97447 Nom IUPAC: 1-(4-chlorophenyl)cyclopentane-1-carboxylic acid SMILES: C1CCC(C1)(C2=CC=C(C=C2)Cl)C(=O)O

Poids moléculaire (g/mol) 224.69
Synonyme 1-4-chlorophenyl cyclopentanecarboxylic acid,1-4-chlorophenyl-1-cyclopentanecarboxylic acid,1-4-chlorophenyl cyclopentane-1-carboxylic acid,cyclopentanecarboxylic acid, 1-4-chlorophenyl,asischem d50961,timtec-bb sbb000649,acmc-209pk2,labotest-bb lt00453384,1-4-chloro phenyl cyclopentanecarboxylic acid,1-4-chloro-phenyl-cyclopentylcarboxylic acid
Numéro MDL MFCD00001373
CAS 80789-69-1
CID PubChem 97447
Nom IUPAC 1-(4-chlorophenyl)cyclopentane-1-carboxylic acid
Clé InChI QJNFJEMGWIQMJT-UHFFFAOYSA-N
SMILES C1CCC(C1)(C2=CC=C(C=C2)Cl)C(=O)O
Formule moléculaire C12H13ClO2
9

4-Chlorophenoxyacetic acid, 98%

CAS: 122-88-3 Formule moléculaire: C8H7ClO3 Poids moléculaire (g/mol): 186.59 Numéro MDL: MFCD00004305 Clé InChI: SODPIMGUZLOIPE-UHFFFAOYSA-N Synonyme: 4-chlorophenoxyacetic acid,2-4-chlorophenoxy acetic acid,4-chlorophenoxy acetic acid,4-cpa,sure-set,tomatotone,tomato fix,acetic acid, 4-chlorophenoxy,p-chlorophenoxyacetic acid,tomato hold CID PubChem: 26229 ChEBI: CHEBI:1808 Nom IUPAC: 2-(4-chlorophenoxy)acetic acid SMILES: C1=CC(=CC=C1OCC(=O)O)Cl

Poids moléculaire (g/mol) 186.59
Synonyme 4-chlorophenoxyacetic acid,2-4-chlorophenoxy acetic acid,4-chlorophenoxy acetic acid,4-cpa,sure-set,tomatotone,tomato fix,acetic acid, 4-chlorophenoxy,p-chlorophenoxyacetic acid,tomato hold
Numéro MDL MFCD00004305
CAS 122-88-3
CID PubChem 26229
ChEBI CHEBI:1808
Nom IUPAC 2-(4-chlorophenoxy)acetic acid
Clé InChI SODPIMGUZLOIPE-UHFFFAOYSA-N
SMILES C1=CC(=CC=C1OCC(=O)O)Cl
Formule moléculaire C8H7ClO3
10

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.

11

2,3,5-Trichlorobenzeneboronic acid, 98%

CAS: 212779-19-6 Formule moléculaire: C6H4BCl3O2 Poids moléculaire (g/mol): 225.26 Numéro MDL: MFCD01630856 Clé InChI: OPBCCRZCYTUJMS-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 5106508 Nom IUPAC: (2,3,5-trichlorophenyl)boronic acid SMILES: OB(O)C1=CC(Cl)=CC(Cl)=C1Cl

Poids moléculaire (g/mol) 225.26
Synonyme 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
Numéro MDL MFCD01630856
CAS 212779-19-6
CID PubChem 5106508
Nom IUPAC (2,3,5-trichlorophenyl)boronic acid
Clé InChI OPBCCRZCYTUJMS-UHFFFAOYSA-N
SMILES OB(O)C1=CC(Cl)=CC(Cl)=C1Cl
Formule moléculaire C6H4BCl3O2
12

2-Chlorothiobenzamide, 97%

CAS: 15717-17-6 Formule moléculaire: C7H6ClNS Poids moléculaire (g/mol): 171.642 Numéro MDL: MFCD00040955 Clé InChI: FLQYOORLPNYQEV-UHFFFAOYSA-N CID PubChem: 2734824 Nom IUPAC: 2-chlorobenzenecarbothioamide SMILES: C1=CC=C(C(=C1)C(=S)N)Cl

Poids moléculaire (g/mol) 171.642
Numéro MDL MFCD00040955
CAS 15717-17-6
CID PubChem 2734824
Nom IUPAC 2-chlorobenzenecarbothioamide
Clé InChI FLQYOORLPNYQEV-UHFFFAOYSA-N
SMILES C1=CC=C(C(=C1)C(=S)N)Cl
Formule moléculaire C7H6ClNS
13

2-Chloro-6-methylbenzonitrile, 98%

CAS: 6575-09-3 Numéro MDL: MFCD00001782

Numéro MDL MFCD00001782
CAS 6575-09-3
14

4-Chloro-2-fluorobenzonitrile, 98+%

CAS: 57381-51-8 Formule moléculaire: C7H3ClFN Poids moléculaire (g/mol): 155.556 Numéro MDL: MFCD00143284 Clé InChI: JRDMGVGCATYZPW-UHFFFAOYSA-N Synonyme: 2-fluoro-4-chlorobenzonitrile,4-chloro-2-fluoro-benzonitrile,benzonitrile, 4-chloro-2-fluoro,4-chloro-2-fluorobenzenecarbonitrile,ncr dg bf,pubchem3424,1-chloro-3-fluorobezene,acmc-1b0zj,ksc493o3h CID PubChem: 93655 Nom IUPAC: 4-chloro-2-fluorobenzonitrile SMILES: C1=CC(=C(C=C1Cl)F)C#N

Poids moléculaire (g/mol) 155.556
Synonyme 2-fluoro-4-chlorobenzonitrile,4-chloro-2-fluoro-benzonitrile,benzonitrile, 4-chloro-2-fluoro,4-chloro-2-fluorobenzenecarbonitrile,ncr dg bf,pubchem3424,1-chloro-3-fluorobezene,acmc-1b0zj,ksc493o3h
Numéro MDL MFCD00143284
CAS 57381-51-8
CID PubChem 93655
Nom IUPAC 4-chloro-2-fluorobenzonitrile
Clé InChI JRDMGVGCATYZPW-UHFFFAOYSA-N
SMILES C1=CC(=C(C=C1Cl)F)C#N
Formule moléculaire C7H3ClFN
15

2-Chlorobenzeneboronic acid, 97%

CAS: 3900-89-8 Formule moléculaire: C6H6BClO2 Poids moléculaire (g/mol): 156.37 Numéro MDL: MFCD00674012 Clé InChI: RRCMGJCFMJBHQC-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 2734322 Nom IUPAC: (2-chlorophenyl)boronic acid SMILES: OB(O)C1=CC=CC=C1Cl

Poids moléculaire (g/mol) 156.37
Synonyme 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
Numéro MDL MFCD00674012
CAS 3900-89-8
CID PubChem 2734322
Nom IUPAC (2-chlorophenyl)boronic acid
Clé InChI RRCMGJCFMJBHQC-UHFFFAOYSA-N
SMILES OB(O)C1=CC=CC=C1Cl
Formule moléculaire C6H6BClO2