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Substance Name: Butanoic acid, 2-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-4-hydroxy-
RN: 83677-17-2
InChIKey: RVAONIDBRIBHMK-UKTHLTGXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H28-O4

Molecular Weight

  • 320.4262
 
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Names and Synonyms

Synonyms

  • 2-((3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-4-hydroxybutanoic acid
  • beta-Carboxy-beta-(2-hydroxyethyl)-3,5-di-tert-butyl-4-hydroxystyrene

Systematic Name

  • Butanoic acid, 2-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-4-hydroxy-

Registry Numbers

CAS Registry Number

  • 83677-17-2

System Generated Number

  • 0083677172

Structure Descriptors

InChI

1S/C19H28O4/c1-18(2,3)14-10-12(9-13(7-8-20)17(22)23)11-15(16(14)21)19(4,5)6/h9-11,20-21H,7-8H2,1-6H3,(H,22,23)/b13-9+

InChIKey

RVAONIDBRIBHMK-UKTHLTGXSA-N

Smiles

CC(C)(C)c1cc(cc(c1O)C(C)(C)C)/C=C(\CCO)/C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   European Patent Application. Vol. #0057881,