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

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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

Chlorobenzene, 99+%, pure

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

1-(4-Chlorophenyl)-1-cyclopropanecarboxylic acid, 99%

CAS: 72934-37-3 Molecular Formula: C₁₀H₉ClO₂ Molecular Weight (g/mol): 196.63 MDL Number: MFCD00001289 InChI Key: YAHLWSGIQJATGG-UHFFFAOYSA-N Synonym: 1-4-chlorophenyl cyclopropanecarboxylic acid,1-4-chlorophenyl cyclopropane-1-carboxylic acid,1-4-chlorophenyl-1-cyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-4-chlorophenyl,1-p-chlorophenyl cyclopropanecarboxylic acid,acmc-209oos,1-4-chlorophenyl cyclopropanecarboxylicacid,1-4chloro-phenyl-cyclopropylcarboxylic acid,1-4-chloro-phenyl-cyclopropylcarboxylic acid PubChem CID: 98606 IUPAC Name: 1-(4-chlorophenyl)cyclopropane-1-carboxylic acid SMILES: C1CC1(C2=CC=C(C=C2)Cl)C(=O)O

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Specifications

PubChem CID	98606
CAS	72934-37-3
Molecular Weight (g/mol)	196.63
MDL Number	MFCD00001289
SMILES	C1CC1(C2=CC=C(C=C2)Cl)C(=O)O
Synonym	1-4-chlorophenyl cyclopropanecarboxylic acid,1-4-chlorophenyl cyclopropane-1-carboxylic acid,1-4-chlorophenyl-1-cyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-4-chlorophenyl,1-p-chlorophenyl cyclopropanecarboxylic acid,acmc-209oos,1-4-chlorophenyl cyclopropanecarboxylicacid,1-4chloro-phenyl-cyclopropylcarboxylic acid,1-4-chloro-phenyl-cyclopropylcarboxylic acid
IUPAC Name	1-(4-chlorophenyl)cyclopropane-1-carboxylic acid
InChI Key	YAHLWSGIQJATGG-UHFFFAOYSA-N
Molecular Formula	C₁₀H₉ClO₂

6-Chloro-2,4-difluoroaniline, 97%

CAS: 36556-56-6 Molecular Formula: C₆H₄ClF₂N Molecular Weight (g/mol): 163.55 MDL Number: MFCD00142892 InChI Key: DUPRZIYJXCCXQZ-UHFFFAOYSA-N Synonym: 6-chloro-2,4-difluoroaniline,4,6-difluoro-2-chloroaniline,2-amino-3,5-difluorochlorobenzene,benzenamine, 2-chloro-4,6-difluoro,2-chloro-4,6-difluorophenylamine,pubchem2940,acmc-1aj0r,ksc226e0f,2,4-difluoro-6-chloroaniline,2-chloro-4,6 difluoro aniline PubChem CID: 2734083 IUPAC Name: 2-chloro-4,6-difluoroaniline SMILES: C1=C(C=C(C(=C1F)N)Cl)F

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Specifications

PubChem CID	2734083
CAS	36556-56-6
Molecular Weight (g/mol)	163.55
MDL Number	MFCD00142892
SMILES	C1=C(C=C(C(=C1F)N)Cl)F
Synonym	6-chloro-2,4-difluoroaniline,4,6-difluoro-2-chloroaniline,2-amino-3,5-difluorochlorobenzene,benzenamine, 2-chloro-4,6-difluoro,2-chloro-4,6-difluorophenylamine,pubchem2940,acmc-1aj0r,ksc226e0f,2,4-difluoro-6-chloroaniline,2-chloro-4,6 difluoro aniline
IUPAC Name	2-chloro-4,6-difluoroaniline
InChI Key	DUPRZIYJXCCXQZ-UHFFFAOYSA-N
Molecular Formula	C₆H₄ClF₂N

3-chloro-4-methylphenylboronic acid, 97%, Thermo Scientific Chemicals

CAS: 175883-63-3 Molecular Formula: C7H8BClO2 Molecular Weight (g/mol): 170.40 MDL Number: MFCD04039010 InChI Key: YTJUYWRCAZWVSX-UHFFFAOYSA-N Synonym: 3-chloro-4-methylphenyl boronic acid,3-chloro-4-methylbenzeneboronic acid,3-chloro-4-methylphenylboronicacid,3-chloro-p-tolylboronic acid,boronic acid, 3-chloro-4-methylphenyl,pubchem5132,3-chloro-4-methyl-phenyl boronic acid,acmc-209eaq,ksc489k9f,3-chloro-4-methylphenyl-boronic acid PubChem CID: 3854610 IUPAC Name: (3-chloro-4-methylphenyl)boronic acid SMILES: CC1=CC=C(C=C1Cl)B(O)O

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Specifications

PubChem CID	3854610
CAS	175883-63-3
Molecular Weight (g/mol)	170.40
MDL Number	MFCD04039010
SMILES	CC1=CC=C(C=C1Cl)B(O)O
Synonym	3-chloro-4-methylphenyl boronic acid,3-chloro-4-methylbenzeneboronic acid,3-chloro-4-methylphenylboronicacid,3-chloro-p-tolylboronic acid,boronic acid, 3-chloro-4-methylphenyl,pubchem5132,3-chloro-4-methyl-phenyl boronic acid,acmc-209eaq,ksc489k9f,3-chloro-4-methylphenyl-boronic acid
IUPAC Name	(3-chloro-4-methylphenyl)boronic acid
InChI Key	YTJUYWRCAZWVSX-UHFFFAOYSA-N
Molecular Formula	C7H8BClO2

2-Chlorophenethyl bromide, 95%

CAS: 16793-91-2 Molecular Formula: C₈H₈BrCl Molecular Weight (g/mol): 219.51 InChI Key: AECBVDLERUETKG-UHFFFAOYSA-N PubChem CID: 2756963 IUPAC Name: 1-(2-bromoethyl)-2-chlorobenzene SMILES: C1=CC=C(C(=C1)CCBr)Cl

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Specifications

PubChem CID	2756963
CAS	16793-91-2
Molecular Weight (g/mol)	219.51
SMILES	C1=CC=C(C(=C1)CCBr)Cl
IUPAC Name	1-(2-bromoethyl)-2-chlorobenzene
InChI Key	AECBVDLERUETKG-UHFFFAOYSA-N
Molecular Formula	C₈H₈BrCl

4-Chlorophenylacetic acid, 98%

CAS: 1878-66-6 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00004344 InChI Key: CDPKJZJVTHSESZ-UHFFFAOYSA-N Synonym: 4-chlorophenylacetic acid,2-4-chlorophenyl acetic acid,4-chlorophenyl acetic acid,4-chlorobenzeneacetic acid,p-chlorophenylacetic acid,benzeneacetic acid, 4-chloro,p-chlorophenyl acetic acid,2-p-chlorophenyl acetic acid,acetic acid, p-chlorophenyl PubChem CID: 15880 ChEBI: CHEBI:30749 IUPAC Name: 2-(4-chlorophenyl)acetic acid SMILES: OC(=O)CC1=CC=C(Cl)C=C1

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Specifications

PubChem CID	15880
CAS	1878-66-6
Molecular Weight (g/mol)	170.59
ChEBI	CHEBI:30749
MDL Number	MFCD00004344
SMILES	OC(=O)CC1=CC=C(Cl)C=C1
Synonym	4-chlorophenylacetic acid,2-4-chlorophenyl acetic acid,4-chlorophenyl acetic acid,4-chlorobenzeneacetic acid,p-chlorophenylacetic acid,benzeneacetic acid, 4-chloro,p-chlorophenyl acetic acid,2-p-chlorophenyl acetic acid,acetic acid, p-chlorophenyl
IUPAC Name	2-(4-chlorophenyl)acetic acid
InChI Key	CDPKJZJVTHSESZ-UHFFFAOYSA-N
Molecular Formula	C8H7ClO2

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

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

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Specifications

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

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

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Specifications

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

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

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

CAS: 80789-69-1 Molecular Formula: C₁₂H₁₃ClO₂ Molecular Weight (g/mol): 224.69 MDL Number: MFCD00001373 InChI Key: QJNFJEMGWIQMJT-UHFFFAOYSA-N Synonym: 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 PubChem CID: 97447 IUPAC Name: 1-(4-chlorophenyl)cyclopentane-1-carboxylic acid SMILES: C1CCC(C1)(C2=CC=C(C=C2)Cl)C(=O)O

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Specifications

PubChem CID	97447
CAS	80789-69-1
Molecular Weight (g/mol)	224.69
MDL Number	MFCD00001373
SMILES	C1CCC(C1)(C2=CC=C(C=C2)Cl)C(=O)O
Synonym	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
IUPAC Name	1-(4-chlorophenyl)cyclopentane-1-carboxylic acid
InChI Key	QJNFJEMGWIQMJT-UHFFFAOYSA-N
Molecular Formula	C₁₂H₁₃ClO₂

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

Proguanil hydrochloride, 97%

CAS: 637-32-1 Molecular Formula: C₁₁H₁₆ClN₅·HCl Molecular Weight (g/mol): 290.19 InChI Key: SARMGXPVOFNNNG-UHFFFAOYSA-N Synonym: proguanil hydrochloride,diguanyl,paludrine,proguanil hcl,chlorguanide hydrochloride,chloroquanil,bigumalum,chloroguanide hydrochloride,tirian hydrochloride,palusil hydrochloride PubChem CID: 9570076 IUPAC Name: (1E)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine;hydrochloride SMILES: CC(C)N=C(N)N=C(N)NC1=CC=C(C=C1)Cl.Cl

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Specifications

PubChem CID	9570076
CAS	637-32-1
Molecular Weight (g/mol)	290.19
SMILES	CC(C)N=C(N)N=C(N)NC1=CC=C(C=C1)Cl.Cl
Synonym	proguanil hydrochloride,diguanyl,paludrine,proguanil hcl,chlorguanide hydrochloride,chloroquanil,bigumalum,chloroguanide hydrochloride,tirian hydrochloride,palusil hydrochloride
IUPAC Name	(1E)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine;hydrochloride
InChI Key	SARMGXPVOFNNNG-UHFFFAOYSA-N
Molecular Formula	C₁₁H₁₆ClN₅·HCl

2-Amino-4-chlorobenzonitrile, 99%

CAS: 38487-86-4 Molecular Formula: C₇H₅ClN₂ Molecular Weight (g/mol): 152.58 InChI Key: UZHALXIAWJOLLR-UHFFFAOYSA-N Synonym: benzonitrile, 2-amino-4-chloro,5-chloro-2-cyanoaniline,4-chloro-2-aminobenzonitrile,4-chloroanthranilonitrile,2-amino-4-chlorobenzenecarbonitrile,pubchem20756,2-amino-4-chloroberizonitrile,bidd:gt0102,2-amino-4-chlorobenzonitrile,2-amino-4-chloro-benzonitrile PubChem CID: 170059 IUPAC Name: 2-amino-4-chlorobenzonitrile SMILES: C1=CC(=C(C=C1Cl)N)C#N

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Specifications

PubChem CID	170059
CAS	38487-86-4
Molecular Weight (g/mol)	152.58
SMILES	C1=CC(=C(C=C1Cl)N)C#N
Synonym	benzonitrile, 2-amino-4-chloro,5-chloro-2-cyanoaniline,4-chloro-2-aminobenzonitrile,4-chloroanthranilonitrile,2-amino-4-chlorobenzenecarbonitrile,pubchem20756,2-amino-4-chloroberizonitrile,bidd:gt0102,2-amino-4-chlorobenzonitrile,2-amino-4-chloro-benzonitrile
IUPAC Name	2-amino-4-chlorobenzonitrile
InChI Key	UZHALXIAWJOLLR-UHFFFAOYSA-N
Molecular Formula	C₇H₅ClN₂

Chlorobenzene

Chlorobenzene

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