34675-84-8

Basic information

• Product Name: CETRAXATE, HYDROCHLORIDE
• Synonyms: NEURER;DV-1006;CETRAXATE HCL;CETRAXATE, HYDROCHLORIDE;cetraxate;p-hydroxy-,4-(aminomethyl)cyclohexanecarboxylate,trans-hydrocinnamicaci;trans-benzenepropanoicaci;trans-4-[[[4-(Aminomethyl)cyclohexyl]carbonyl]oxy]benzenepropanoic acid
• CAS NO: 34675-84-8
• Molecular Formula: C₁₇H₂₃NO₄
• Molecular Weight: 341.83
• Mol File: 34675-84-8.mol
• Article Data: 2

Chemical Properties

• Melting Point: melts over a range of 200-280°
• Boiling Point: 446.09°C (rough estimate)
• Flash Point: 244.6°C
• Appearance: /
• Density: 1.0817 (rough estimate)
• Vapor Pressure: 4.67E-10mmHg at 25°C
• Refractive Index: 1.5200 (estimate)
• Storage Temp.: 2-8°C
• Solubility: DMSO (Slightly), Methanol (Slightly)
• PKA: 4.61±0.10(Predicted)
• CAS DataBase Reference: CETRAXATE, HYDROCHLORIDE(CAS DataBase Reference)
• NIST Chemistry Reference: CETRAXATE, HYDROCHLORIDE(34675-84-8)
• EPA Substance Registry System: CETRAXATE, HYDROCHLORIDE(34675-84-8)

Safety Data

• Hazardous Substances Data: 34675-84-8(Hazardous Substances Data)

Usage

Uses

Anti-ulcerative (gastrointestinal).

InChI:InChI=1/C17H23NO4/c18-11-13-1-6-14(7-2-13)17(21)22-15-8-3-12(4-9-15)5-10-16(19)20/h3-4,8-9,13-14H,1-2,5-7,10-11,18H2,(H,19,20)

Upstream product

• 27687-12-3 (1r,4r)-4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexane-1-carboxylic acid 
• 38688-44-7 4-(Benzyloxycarbonylamino-methyl)-cyclohexanecarboxylic acid 4-(2-benzyloxycarbonyl-ethyl)-phenyl ester 
• 122224-25-3 4-Cyano-cyclohexanecarboxylic acid 4-(2-benzyloxycarbonyl-ethyl)-phenyl ester 
• 31770-76-0 3-(4-hydroxyphenyl)propionic acid benzyl ester 
• 501-97-3 4-hydroxyphenylpropionic acid 
• 27687-13-4 trans-4-(N-carbobenzyloxy)aminomethyl-1-cyclohexane carbonyl chloride 

Relevant articles and documents

Biocatalytic deprotection of a cetraxate ester by Microbacterium sp. strain 7-1W cells

Enzymatic deprotection of the terminal ester bond of a cetraxate methyl ester was done with resting cells of Microbacterium sp. strain 7-1W, which produces an esterase catalyzing a regioselective hydrolysis reaction, as the catalyst. When 20 g of cetraxate methyl ester in 50 ml of a reaction mixture was incubated with 5 g of wet cells for 17 h, 96% of the substrate was converted to the desired product, cetraxate, quantitatively.