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Substance Name: (E)-2-(3,5-Di-t-butyl-4-hydroxybenzylidene)indan-1-one
RN: 137506-95-7
InChIKey: SMPSMMSABMAUMB-GZTJUZNOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H28-O2

Molecular Weight

  • 348.4832
 
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Names and Synonyms

Results Name

  • (E)-2-(3,5-Di-t-butyl-4-hydroxybenzylidene)indan-1-one

Synonyms

  • (E)-2,3-Dihydro-2-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-1H-inden-1-one
  • (E)-2-(3,5-Di-tert-butyl-4-hydroxybenzylidene)indan-1-one
  • BRN 4818431

Systematic Name

  • 1H-Inden-1-one, 2,3-dihydro-2-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-, (E)-

Registry Numbers

CAS Registry Number

  • 137506-95-7

System Generated Number

  • 0137506957

Structure Descriptors

InChI

1S/C24H28O2/c1-23(2,3)19-12-15(13-20(22(19)26)24(4,5)6)11-17-14-16-9-7-8-10-18(16)21(17)25/h7-13,26H,14H2,1-6H3/b17-11+

InChIKey

SMPSMMSABMAUMB-GZTJUZNOSA-N

Smiles

CC(C)(C)c1cc(cc(c1O)C(C)(C)C)/C=C/2\Cc3ccccc3C2=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD oral > 2gm/kg (2000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 551, 1991.