5-Hydroxydiclofenac
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5-Hydroxydiclofenac
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CAS No:
69002-84-2
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Formula:
C14H11Cl2NO3
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Chemical Name:
5-Hydroxydiclofenac
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Synonyms:
Benzeneacetic acid,2-[(2,6-dichlorophenyl)amino]-5-hydroxy-;2-[(2,6-Dichlorophenyl)amino]-5-hydroxybenzeneacetic acid;5-Hydroxydiclofenac;2-[2-(2,6-Dichloroanilino)-5-hydroxyphenyl]acetic acid;2-(2-((2,6-Dichlorophenyl)amino)-5-hydroxyphenyl)acetic acid
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CAS No:
Description
5-hydroxydiclofenac is a monocarboxylic acid that is the 5-hydroxylated metabolite of diclofenac. It has a role as a drug metabolite and an allergen. It is a dichlorobenzene, a monocarboxylic acid, a member of phenols and a secondary amino compound. It derives from a diclofenac.
Drug Information
5-Hydroxydiclofenac is a known transformation product of Diclofenac.
5-hydroxydiclofenac has known human metabolites that include (2S,3S,4S,5R)-6-[3-(carboxymethyl)-4-(2,6-dichloroanilino)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid, 2-[2-(2,6-dichloroanilino)-5-sulfooxyphenyl]acetic acid, and 4',5-Dihydroxydiclofenac.
(2-((2,6-dichlorophenyl)amino)-5-hydroxyphenyl)acetic acid
Computed Properties
Molecular Weight:312.1
XLogP3:3.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:311.0115986
Monoisotopic Mass:311.0115986
Topological Polar Surface Area:69.6
Heavy Atom Count:20
Complexity:332
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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