Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.

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1,846 – 1,860 of 64,662 results

1,846

Bis(tri-o-tolylphosphine)palladium(0), Pd 14.9%

CAS: 69861-71-8 Molecular Formula: C42H42P2Pd Molecular Weight (g/mol): 715.166 MDL Number: MFCD12911908 InChI Key: CUBIJGNGGJBNOC-UHFFFAOYSA-N Synonym: bis tri-o-tolylphosphine palladium 0,pd o-tol 3p 2,bis tris 2-methylphenyl phosphine palladium,bis tris 2-tolyl phosphine palladium,palladium, bis tris 2-methylphenyl phosphine,bis tris 2-methylphenyl phosphane palladium PubChem CID: 10952654 IUPAC Name: palladium;tris(2-methylphenyl)phosphane SMILES: CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.[Pd]

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Specifications

PubChem CID	10952654
CAS	69861-71-8
Molecular Weight (g/mol)	715.166
MDL Number	MFCD12911908
SMILES	CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.[Pd]
Synonym	bis tri-o-tolylphosphine palladium 0,pd o-tol 3p 2,bis tris 2-methylphenyl phosphine palladium,bis tris 2-tolyl phosphine palladium,palladium, bis tris 2-methylphenyl phosphine,bis tris 2-methylphenyl phosphane palladium
IUPAC Name	palladium;tris(2-methylphenyl)phosphane
InChI Key	CUBIJGNGGJBNOC-UHFFFAOYSA-N
Molecular Formula	C42H42P2Pd

1,847

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Benzophenone hydrazone, 98+%

CAS: 5350-57-2 Molecular Formula: C13H12N2 Molecular Weight (g/mol): 196.253 MDL Number: MFCD00007624 InChI Key: QYCSNMDOZNUZIT-UHFFFAOYSA-N Synonym: benzophenone hydrazone,diphenylmethylene hydrazine,benzophenonehydrazone,methanone, diphenyl-, hydrazone,diphenylmethanone hydrazone,benzophenone, hydrazone,diphenylmethylidene hydrazine,diphenyl ketone hydrazone,benzophenone hydrozone,nsc 43 PubChem CID: 79304 IUPAC Name: benzhydrylidenehydrazine SMILES: C1=CC=C(C=C1)C(=NN)C2=CC=CC=C2

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Specifications

PubChem CID	79304
CAS	5350-57-2
Molecular Weight (g/mol)	196.253
MDL Number	MFCD00007624
SMILES	C1=CC=C(C=C1)C(=NN)C2=CC=CC=C2
Synonym	benzophenone hydrazone,diphenylmethylene hydrazine,benzophenonehydrazone,methanone, diphenyl-, hydrazone,diphenylmethanone hydrazone,benzophenone, hydrazone,diphenylmethylidene hydrazine,diphenyl ketone hydrazone,benzophenone hydrozone,nsc 43
IUPAC Name	benzhydrylidenehydrazine
InChI Key	QYCSNMDOZNUZIT-UHFFFAOYSA-N
Molecular Formula	C13H12N2

1,848

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1-n-Heptyl-4-iodobenzene, 98%

CAS: 131894-91-2 Molecular Formula: C13H19I Molecular Weight (g/mol): 302.20 MDL Number: MFCD07777084 InChI Key: NHXKOPSTJPLWPK-UHFFFAOYSA-N Synonym: 1-n-heptyl-4-iodobenzene,4-heptyl-1-iodobenzene PubChem CID: 15001646 IUPAC Name: 1-heptyl-4-iodobenzene SMILES: CCCCCCCC1=CC=C(I)C=C1

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Specifications

PubChem CID	15001646
CAS	131894-91-2
Molecular Weight (g/mol)	302.20
MDL Number	MFCD07777084
SMILES	CCCCCCCC1=CC=C(I)C=C1
Synonym	1-n-heptyl-4-iodobenzene,4-heptyl-1-iodobenzene
IUPAC Name	1-heptyl-4-iodobenzene
InChI Key	NHXKOPSTJPLWPK-UHFFFAOYSA-N
Molecular Formula	C13H19I

1,849

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Benzyl Alcohol, NF, EP, BP, JP, bioCERTIFIED™, 500 mL, Spectrum Chemical

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1,850

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2-(Diphenylphosphino)benzaldehyde oxime, 95%, Thermo Scientific Chemicals

CAS: 153358-05-5 Molecular Formula: C19H16NOP Molecular Weight (g/mol): 305.32 MDL Number: MFCD16251585 InChI Key: XHIVESUSSLEMGJ-UHFFFAOYSA-N Synonym: 2-diphenylphosphino benzaldehyde oxime,n-2-diphenylphosphino benzylidene hydroxylamine,e-n-2-diphenylphosphanyl phenyl methylidene hydroxylamine PubChem CID: 98043674 IUPAC Name: (NZ)-N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine SMILES: ON=CC1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	98043674
CAS	153358-05-5
Molecular Weight (g/mol)	305.32
MDL Number	MFCD16251585
SMILES	ON=CC1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	2-diphenylphosphino benzaldehyde oxime,n-2-diphenylphosphino benzylidene hydroxylamine,e-n-2-diphenylphosphanyl phenyl methylidene hydroxylamine
IUPAC Name	(NZ)-N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine
InChI Key	XHIVESUSSLEMGJ-UHFFFAOYSA-N
Molecular Formula	C19H16NOP

1,851

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4-Bromo-2-fluorotoluene, 99%

CAS: 51436-99-8 Molecular Formula: C7H6BrF Molecular Weight (g/mol): 189.027 MDL Number: MFCD00013551 InChI Key: YZFVUQSAJMLFOZ-UHFFFAOYSA-N Synonym: 4-bromo-2-fluorotoluene,2-fluoro-4-bromotoluene,benzene, 4-bromo-2-fluoro-1-methyl,toluene,2-fluoro-4-bromo,4-bromo-2-fluoro-1-methyl-benzene,pubchem1601,acmc-1an2v,2-fluoro-4-bromo toluene,4-bromo-2-fluoro-toluene PubChem CID: 171040 IUPAC Name: 4-bromo-2-fluoro-1-methylbenzene SMILES: CC1=C(C=C(C=C1)Br)F

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Specifications

PubChem CID	171040
CAS	51436-99-8
Molecular Weight (g/mol)	189.027
MDL Number	MFCD00013551
SMILES	CC1=C(C=C(C=C1)Br)F
Synonym	4-bromo-2-fluorotoluene,2-fluoro-4-bromotoluene,benzene, 4-bromo-2-fluoro-1-methyl,toluene,2-fluoro-4-bromo,4-bromo-2-fluoro-1-methyl-benzene,pubchem1601,acmc-1an2v,2-fluoro-4-bromo toluene,4-bromo-2-fluoro-toluene
IUPAC Name	4-bromo-2-fluoro-1-methylbenzene
InChI Key	YZFVUQSAJMLFOZ-UHFFFAOYSA-N
Molecular Formula	C7H6BrF

1,852

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Toluene-2,6-diisocyanate, 97%

CAS: 91-08-7 Molecular Formula: C9H6N2O2 Molecular Weight (g/mol): 174.159 MDL Number: MFCD00002010 InChI Key: RUELTTOHQODFPA-UHFFFAOYSA-N Synonym: 2,6-diisocyanatotoluene,toluene-2,6-diisocyanate,2,6-toluene diisocyanate,2-methyl-m-phenylene diisocyanate,2,6-tdi,m-tolylene diisocyanate,meta-tolylene diisocyanate,toluene 2,6-diisocyanate,benzene, 1,3-diisocyanato-2-methyl,2,6-diisocyanato-1-methylbenzene PubChem CID: 7040 ChEBI: CHEBI:53557 IUPAC Name: 1,3-diisocyanato-2-methylbenzene SMILES: CC1=C(C=CC=C1N=C=O)N=C=O

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Specifications

PubChem CID	7040
CAS	91-08-7
Molecular Weight (g/mol)	174.159
ChEBI	CHEBI:53557
MDL Number	MFCD00002010
SMILES	CC1=C(C=CC=C1N=C=O)N=C=O
Synonym	2,6-diisocyanatotoluene,toluene-2,6-diisocyanate,2,6-toluene diisocyanate,2-methyl-m-phenylene diisocyanate,2,6-tdi,m-tolylene diisocyanate,meta-tolylene diisocyanate,toluene 2,6-diisocyanate,benzene, 1,3-diisocyanato-2-methyl,2,6-diisocyanato-1-methylbenzene
IUPAC Name	1,3-diisocyanato-2-methylbenzene
InChI Key	RUELTTOHQODFPA-UHFFFAOYSA-N
Molecular Formula	C9H6N2O2

1,853

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4-Amino-3-iodobenzonitrile, 97%

CAS: 33348-34-4 Molecular Formula: C7H5IN2 Molecular Weight (g/mol): 244.035 MDL Number: MFCD04039964 InChI Key: UOWVTQFTEAYDLM-UHFFFAOYSA-N Synonym: 4-cyano-2-iodoaniline,1-amino-2-iodo-4-cyanobenzene,benzonitrile, 4-amino-3-iodo,4-amino-2-iodobenzonitrile 98,4-amino-3-iodobenzenecarbonitrile,2-iodo-4-cyanoaniline,4-cyano-6-iodoaniline,pubchem18486,acmc-20a6lw,3-iodo-4-aminobenzonitrile PubChem CID: 4416395 IUPAC Name: 4-amino-3-iodobenzonitrile SMILES: C1=CC(=C(C=C1C#N)I)N

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Specifications

PubChem CID	4416395
CAS	33348-34-4
Molecular Weight (g/mol)	244.035
MDL Number	MFCD04039964
SMILES	C1=CC(=C(C=C1C#N)I)N
Synonym	4-cyano-2-iodoaniline,1-amino-2-iodo-4-cyanobenzene,benzonitrile, 4-amino-3-iodo,4-amino-2-iodobenzonitrile 98,4-amino-3-iodobenzenecarbonitrile,2-iodo-4-cyanoaniline,4-cyano-6-iodoaniline,pubchem18486,acmc-20a6lw,3-iodo-4-aminobenzonitrile
IUPAC Name	4-amino-3-iodobenzonitrile
InChI Key	UOWVTQFTEAYDLM-UHFFFAOYSA-N
Molecular Formula	C7H5IN2

1,854

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4-Cyanobenzoic acid, 99%

CAS: 619-65-8 Molecular Formula: C₈H₅NO₂ Molecular Weight (g/mol): 147.13 MDL Number: MFCD00002528 InChI Key: ADCUEPOHPCPMCE-UHFFFAOYSA-N Synonym: p-cyanobenzoic acid,benzoic acid, 4-cyano,p-carboxybenzonitrile,4-carboxybenzonitrile,benzoic acid, p-cyano,4-cyano-benzoic acid,4-cyano benzoic acid,benzoicacid, 4-cyano,4-cyanobenzoicacid,para-cyanobenzoic acid PubChem CID: 12087 IUPAC Name: 4-cyanobenzoic acid SMILES: C1=CC(=CC=C1C#N)C(=O)O

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Specifications

PubChem CID	12087
CAS	619-65-8
Molecular Weight (g/mol)	147.13
MDL Number	MFCD00002528
SMILES	C1=CC(=CC=C1C#N)C(=O)O
Synonym	p-cyanobenzoic acid,benzoic acid, 4-cyano,p-carboxybenzonitrile,4-carboxybenzonitrile,benzoic acid, p-cyano,4-cyano-benzoic acid,4-cyano benzoic acid,benzoicacid, 4-cyano,4-cyanobenzoicacid,para-cyanobenzoic acid
IUPAC Name	4-cyanobenzoic acid
InChI Key	ADCUEPOHPCPMCE-UHFFFAOYSA-N
Molecular Formula	C₈H₅NO₂

1,855

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Methyl 3,5-dibromo-4-hydroxybenzoate, 98%

CAS: 41727-47-3 Molecular Formula: C8H6Br2O3 Molecular Weight (g/mol): 309.941 MDL Number: MFCD00016416 InChI Key: NVGJGYZKXBLIKY-UHFFFAOYSA-N Synonym: 3,5-dibromo-4-hydroxybenzoic acid methyl ester,3,5-dibromo-4-hydroxy-benzoic acid methyl ester,methyl 3,5-bis bromanyl-4-oxidanyl-benzoate,acmc-20akhs,pubchem3978,methyl dibromosalicylate,rarechem al bf 0231,timtec-bb sbb012530,labotest-bb lt00455670,labotest-bb lt03332530 PubChem CID: 726975 IUPAC Name: methyl 3,5-dibromo-4-hydroxybenzoate SMILES: COC(=O)C1=CC(=C(C(=C1)Br)O)Br

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Specifications

PubChem CID	726975
CAS	41727-47-3
Molecular Weight (g/mol)	309.941
MDL Number	MFCD00016416
SMILES	COC(=O)C1=CC(=C(C(=C1)Br)O)Br
Synonym	3,5-dibromo-4-hydroxybenzoic acid methyl ester,3,5-dibromo-4-hydroxy-benzoic acid methyl ester,methyl 3,5-bis bromanyl-4-oxidanyl-benzoate,acmc-20akhs,pubchem3978,methyl dibromosalicylate,rarechem al bf 0231,timtec-bb sbb012530,labotest-bb lt00455670,labotest-bb lt03332530
IUPAC Name	methyl 3,5-dibromo-4-hydroxybenzoate
InChI Key	NVGJGYZKXBLIKY-UHFFFAOYSA-N
Molecular Formula	C8H6Br2O3

1,856

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3-(Trifluoromethyl)phenylhydrazine, 95%

CAS: 368-78-5 Molecular Formula: C7H7F3N2 Molecular Weight (g/mol): 176.142 MDL Number: MFCD00025093 InChI Key: RSESUCWJKLHXEZ-UHFFFAOYSA-N Synonym: 3-trifluoromethyl phenylhydrazine,3-trifluoromethyl phenyl hydrazine,3-trifluoromethylphenylhydrazine,hydrazine, 3-trifluoromethyl phenyl,3-trifloromethylphenylhydrazine,3-trifluouromethyl phenylhydrazinehydrochloride,3-trifluoromethyl phenylhydrazine hydrochioride,pubchem3280,enamine_001261 PubChem CID: 98650 IUPAC Name: [3-(trifluoromethyl)phenyl]hydrazine SMILES: C1=CC(=CC(=C1)NN)C(F)(F)F

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Specifications

PubChem CID	98650
CAS	368-78-5
Molecular Weight (g/mol)	176.142
MDL Number	MFCD00025093
SMILES	C1=CC(=CC(=C1)NN)C(F)(F)F
Synonym	3-trifluoromethyl phenylhydrazine,3-trifluoromethyl phenyl hydrazine,3-trifluoromethylphenylhydrazine,hydrazine, 3-trifluoromethyl phenyl,3-trifloromethylphenylhydrazine,3-trifluouromethyl phenylhydrazinehydrochloride,3-trifluoromethyl phenylhydrazine hydrochioride,pubchem3280,enamine_001261
IUPAC Name	[3-(trifluoromethyl)phenyl]hydrazine
InChI Key	RSESUCWJKLHXEZ-UHFFFAOYSA-N
Molecular Formula	C7H7F3N2

1,857

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Thermo Scientific Chemicals 5-Sulfosalicylic acid dihydrate, 99+%

CAS: 5965-83-3 | C9H14O6S | 250.27 g/mol

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Specifications

Molecular Weight (g/mol)	250.27
CAS Min %	99.0
InChI Key	NFYHZVWMQHQKRU-UHFFFAOYSA-N
PubChem CID	2723734
Name Note	p.a.
Percent Purity	99+%
Fieser	01,1118
Infrared Spectrum	Authentic
Formula Weight	254.22
Melting Point	106.0°C to 110.0°C
CAS Max %	100.0
Color	White
Physical Form	Crystalline Powder
Chemical Name or Material	5-Sulfosalicylic acid dihydrate
SMILES	C.C.OC(=O)C1=CC(=CC=C1O)S(O)(=O)=O
Merck Index	15, 9094
Assay Percent Range	99+%
CAS	97-05-2
Health Hazard 3	GHS P Statement IF SWALLOWED: rinse mouth. Do NOT induce vomiting. Wear protective gloves/protective clothing/eye protection/face protection. IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses,if pre
MDL Number	MFCD00007508,MFCD00149540
Health Hazard 2	GHS H Statement Causes severe skin burns and eye damage. Harmful if swallowed.
Solubility Information	Solubility in water: 127g/L (20°C). Other solubilities: soluble in alcohol and ether
Packaging	Plastic bottle
Health Hazard 1	GHS Signal Word: Danger
Synonym	2-hydroxy-5-sulfobenzoic acid dihydrate,5-sulfosalicylic acid dihydrate,sulfosalicylic acid dihydrate,benzoic acid, 2-hydroxy-5-sulfo-, dihydrate,unii-09ngq462s6,2-hydroxy-5-sulfobenzoic acid, hydrate, hydrate,5-sulfosalicylsyre,5-sulfosalicylsaeure,salicylic acid, 5-sulfo-, dihydrate,acmc-1aymd
Beilstein	11, 411
Molecular Formula	C9H14O6S

1,858

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Triphenylphosphonium bromide, 99%

CAS: 6399-81-1 Molecular Formula: C18H16BrP Molecular Weight (g/mol): 343.20 MDL Number: MFCD00035107 InChI Key: CMSYDJVRTHCWFP-UHFFFAOYSA-N Synonym: triphenylphosphine hydrobromide,triphenylphosphonium bromide,phosphine, triphenyl-, hydrobromide,triphenylphosphane hydrobromide,triphenylphosphine bromine,pubchem13868,ph3p hbr,ph3p . hbr,unappfzuzwmopv-uhfffaoysa-n PubChem CID: 80811 IUPAC Name: triphenylphosphane;hydrobromide SMILES: Br.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	80811
CAS	6399-81-1
Molecular Weight (g/mol)	343.20
MDL Number	MFCD00035107
SMILES	Br.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	triphenylphosphine hydrobromide,triphenylphosphonium bromide,phosphine, triphenyl-, hydrobromide,triphenylphosphane hydrobromide,triphenylphosphine bromine,pubchem13868,ph3p hbr,ph3p . hbr,unappfzuzwmopv-uhfffaoysa-n
IUPAC Name	triphenylphosphane;hydrobromide
InChI Key	CMSYDJVRTHCWFP-UHFFFAOYSA-N
Molecular Formula	C18H16BrP

1,859

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(3S,4S)-(+)-1-Benzyl-3,4-pyrrolidindiol, 97%, Thermo Scientific Chemicals

CAS: 90365-74-5 MDL Number: MFCD01073893 InChI Key: QJRIUWQPJVPYSO-QWRGUYRKSA-N Synonym: 3s,4s-1-benzylpyrrolidine-3,4-diol,3s,4s-+-1-benzyl-3,4-pyrrolidindiol,3s,4s-+-1-benzyl-3,4-pyrrolidinediol,3s,4s-1-benzyl-3,4-pyrrolidinediol,3s,4s---1-benzyl-3,4-pyrrolidindiol,3,4-pyrrolidinediol, 1-phenylmethyl-, 3s,4s,pubchem18732,3s,4s-1-benzyl-3,4-dihydroxypyrrolidine,3s,4s-1-phenylmethyl-3,4-pyrrolidinediol,3s,4s-+-1-benzyl-3,4-pyrrolidinediol sum of enantiomers, hplc PubChem CID: 2734057 IUPAC Name: (3S,4S)-1-benzylpyrrolidine-3,4-diol SMILES: C1C(C(CN1CC2=CC=CC=C2)O)O

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Specifications

PubChem CID	2734057
CAS	90365-74-5
MDL Number	MFCD01073893
SMILES	C1C(C(CN1CC2=CC=CC=C2)O)O
Synonym	3s,4s-1-benzylpyrrolidine-3,4-diol,3s,4s-+-1-benzyl-3,4-pyrrolidindiol,3s,4s-+-1-benzyl-3,4-pyrrolidinediol,3s,4s-1-benzyl-3,4-pyrrolidinediol,3s,4s---1-benzyl-3,4-pyrrolidindiol,3,4-pyrrolidinediol, 1-phenylmethyl-, 3s,4s,pubchem18732,3s,4s-1-benzyl-3,4-dihydroxypyrrolidine,3s,4s-1-phenylmethyl-3,4-pyrrolidinediol,3s,4s-+-1-benzyl-3,4-pyrrolidinediol sum of enantiomers, hplc
IUPAC Name	(3S,4S)-1-benzylpyrrolidine-3,4-diol
InChI Key	QJRIUWQPJVPYSO-QWRGUYRKSA-N

1,860

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2,4,6-Trichlorobenzoyl chloride, 98%

CAS: 4136-95-2 Molecular Formula: C7H2Cl4O Molecular Weight (g/mol): 243.89 MDL Number: MFCD00075323 InChI Key: OZGSEIVTQLXWRO-UHFFFAOYSA-N Synonym: 2,4,6-trichlorobenzoylchloride,benzoyl chloride, 2,4,6-trichloro,mi,acmc-209jk3,ksc494s2p,2,4,6-cl3c6h2cocl,2,4,6-ttrichlorobenzoyl chloride,2,4,6-trichloro benzoyl chloride,2,4,6-trichlorobenzoic acid chloride,2,4,6-tris chloranyl benzoyl chloride PubChem CID: 2733703 IUPAC Name: 2,4,6-trichlorobenzoyl chloride SMILES: ClC(=O)C1=C(Cl)C=C(Cl)C=C1Cl

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Specifications

PubChem CID	2733703
CAS	4136-95-2
Molecular Weight (g/mol)	243.89
MDL Number	MFCD00075323
SMILES	ClC(=O)C1=C(Cl)C=C(Cl)C=C1Cl
Synonym	2,4,6-trichlorobenzoylchloride,benzoyl chloride, 2,4,6-trichloro,mi,acmc-209jk3,ksc494s2p,2,4,6-cl3c6h2cocl,2,4,6-ttrichlorobenzoyl chloride,2,4,6-trichloro benzoyl chloride,2,4,6-trichlorobenzoic acid chloride,2,4,6-tris chloranyl benzoyl chloride
IUPAC Name	2,4,6-trichlorobenzoyl chloride
InChI Key	OZGSEIVTQLXWRO-UHFFFAOYSA-N
Molecular Formula	C7H2Cl4O

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Benzene and substituted derivatives

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Benzyl Alcohol, NF, EP, BP, JP, bioCERTIFIED™, 500 mL, Spectrum Chemical Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

Benzyl Alcohol, NF, EP, BP, JP, bioCERTIFIED™, 500 mL, Spectrum Chemical