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Sodium gentisate

Sodium gentisate structure

Sodium gentisate 

structure
  • CAS No:

    4955-90-2

  • Formula:

    C7H6O4.Na

  • Chemical Name:

    Sodium gentisate

  • Synonyms:

    Benzoic acid,2,5-dihydroxy-,sodium salt (1:1);Gentisic acid,monosodium salt;Benzoic acid,2,5-dihydroxy-,monosodium salt;Casate Sodium;Gensalate Sodium;Gentasol;Gentisan;Gentisate sodium;5-Hydroxysalicylate sodium;Sodium 2,5-dihydroxybenzoate;Sodium-Gent;Sodium gentisate;Gentisod;Legential;Casate;Gabail;Nagent;Gentalpin;Nagentis;Gentidol;Gentinatre;Gentisinic acid sodium salt;Gentisic acid sodium salt;Gentisine UCB;2,5-Dihydroxybenzoic acid sodium;1300-59-0

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

Off-White Solid

Sodium gentisate Basic Attributes

176.1

176.008560

225-598-2

DX2PUD5H82

DTXSID0063656

Characteristics

80.6

-0.53870

Off-white solid

>220ºC (dec)

406.9°C at 760 mmHg

214ºC

-20ºC Freezer

Safety Information

NONH for all modes of transport

3

LY3860000

Sodium gentisate Use and Manufacturing

Uses

Analgesic; anti-inflammatory. Sodium gentisate is an reactant involved in oxidative coupling reactions followed by the product use as an antioxidant and tyrosinase inhibitor1.

Benzoic acid, 2,5-dihydroxy-, sodium salt (1:1): ACTIVE

Computed Properties

Molecular Weight:176.10
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:176.00855292
Monoisotopic Mass:176.00855292
Topological Polar Surface Area:80.6
Heavy Atom Count:12
Complexity:162
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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