Benzenepropanoic acid, 4-[[[4-(aminomethyl)cyclohexyl]carbonyl]oxy]-, phenylmethyl ester, hydrochloride, trans-
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![Benzenepropanoic acid, 4-[[[4-(aminomethyl)cyclohexyl]carbonyl]oxy]-, phenylmethyl ester, hydrochloride, trans- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/45f4ebd35b6e4015879c444bd803ebb8.png "Benzenepropanoic acid, 4-[[[4-(aminomethyl)cyclohexyl]carbonyl]oxy]-, phenylmethyl ester, hydrochloride, trans-")
Benzenepropanoic acid, 4-[[[4-(aminomethyl)cyclohexyl]carbonyl]oxy]-, phenylmethyl ester, hydrochloride, trans-
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CAS No:
27725-13-9
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Formula:
C24H29NO4.ClH
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Chemical Name:
Benzenepropanoic acid, 4-[[[4-(aminomethyl)cyclohexyl]carbonyl]oxy]-, phenylmethyl ester, hydrochloride, trans-
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Synonyms:
Benzenepropanoic acid,4-[[[4-(aminomethyl)cyclohexyl]carbonyl]oxy]-,phenylmethyl ester,hydrochloride,trans-;Hydrocinnamic acid,p-hydroxy-,benzyl ester,4-(aminomethyl)cyclohexanecarboxylate hydrochloride,trans-;Cyclohexanecarboxylic acid,4-(aminomethyl)-,ester with benzyl p-hydroxyhydrocinnamate,hydrochloride,trans-;Cetraxate benzyl ester hydrochloride
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CAS No:
Description
Benzyl cetraxate is the benzyl ester of cetraxate. It is a benzyl ester and a member of cetraxates. It is a conjugate base of a benzyl cetraxate(1+).
Benzenepropanoic acid, 4-[[[4-(aminomethyl)cyclohexyl]carbonyl]oxy]-, phenylmethyl ester, hydrochloride, trans- Basic Attributes
395.5 g/mol
395.20965841 g/mol
Computed Properties
Molecular Weight:395.5
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:10
Exact Mass:395.20965841
Monoisotopic Mass:395.20965841
Topological Polar Surface Area:78.6
Heavy Atom Count:29
Complexity:501
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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