4-(2-Chloroacetamido)benzoic acid

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4-(2-Chloroacetamido)benzoic acid Basic information
Product Name:4-(2-Chloroacetamido)benzoic acid
Synonyms:AKOS B029036;AKOS BBS-00003998;TIMTEC-BB SBB003412;4-[(CHLOROACETYL)AMINO]BENZOIC ACID;4-(2-chloroethanoylamino)benzoic acid;BUTTPARK 80\07-82;LABOTEST-BB LT00452441;4-(2-Chloro-acetylamino)-benzoic acid
CAS:4596-39-8
MF:C9H8ClNO3
MW:213.62
EINECS:
Product Categories:Building Blocks;Carbonyl Compounds;Carboxylic Acids;Chemical Synthesis;Organic Building Blocks;C9;Carbonyl Compounds;Carboxylic Acids
Mol File:4596-39-8.mol
4-(2-Chloroacetamido)benzoic acid Structure
4-(2-Chloroacetamido)benzoic acid Chemical Properties
Melting point 264 °C (dec.) (lit.)
Boiling point 468.8±30.0 °C(Predicted)
density 1.458±0.06 g/cm3(Predicted)
storage temp. Storage temp. 2-8°C
solubility Acetic Acid (Slightly), DMSO (Slightly)
form Solid
pka4.27±0.10(Predicted)
color White to Off-White
InChI1S/C9H8ClNO3/c10-5-8(12)11-7-3-1-6(2-4-7)9(13)14/h1-4H,5H2,(H,11,12)(H,13,14)
InChIKeyFNXAWVZXABMYRM-UHFFFAOYSA-N
SMILESOC(=O)c1ccc(NC(=O)CCl)cc1
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-36
WGK Germany 3
Storage Class11 - Combustible Solids
Hazard ClassificationsEye Irrit. 2
Skin Irrit. 2
STOT SE 3
MSDS Information
ProviderLanguage
SigmaAldrich English
4-(2-Chloroacetamido)benzoic acid Usage And Synthesis
UsesSynthesis of 4-(2-Chloroacetamido)benzoic acid has been reported. It is reported as key intermediate in the synthesis of series of Matijing-Su (MTS, N-(N-benzoyl-L-phenylalanyl)-O-acetyl-L-phenylalanol) derivatives.
General DescriptionSynthesis of 4-(2-Chloroacetamido)benzoic acid has been reported. It is reported as key intermediate in the synthesis of series of Matijing-Su (MTS, N-(N-benzoyl-L-phenylalanyl)-O-acetyl-L-phenylalanol) derivatives.
4-(2-Chloroacetamido)benzoic acid Preparation Products And Raw materials
Tag:4-(2-Chloroacetamido)benzoic acid(4596-39-8) Related Product Information
N-Methyl-4-(2-chloroacetamido)benzoic acid 4-(2-Chloroacetamido)benzoic acid 4-(2-Chloro-acetylamino)-benzoic acid methyl ester Ethyl 4-(2-chloroacetamido)benzoate 4-(2-Chloro-acetylamino)-2-hydroxy-benzoic acid Ethyl 4-[5-chloro-4-(diethylamino)-6-oxopyridazin-1(6H)-yl]benzoate 5-Chloro-4-[(chloroacetyl)amino]-2-methoxybenzoic acid Ethyl 4-[5-chloro-4-(2,6-dimethylmorpholino)-6-oxopyridazin-1(6H)-yl]benzoate Methyl 5-bromo-4-[(2-chloroacetyl)amino]-2-methoxybenzenecarboxylate Ethyl 4-(3,4-dichloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoate Ethyl 1-(5-chloro-1-[4-(ethoxycarbonyl)phenyl]-6-oxo-1,6-dihydropyridazin-4-yl)piperidine-4-carboxylate Ethyl 4-[5-chloro-4-morpholino-6-oxopyridazin-1(6H)-yl]benzoate Ethyl 4-(4,5-dichloro-6-oxo-1,6-dihydropyridazin-1-yl)benzoate AKOS B029740 AURORA 14373 Propyl 4-[(chloroacetyl)amino]benzoate 4-(4,5-Dichloro-6-oxopyridazin-1(6H)-yl)benzoic acid Butyl 4-[(chloroacetyl)amino]benzoate