Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1(2H)-Naphthalenone, 3,4-dihydro-2-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-, (Z)-
RN: 137506-96-8
InChIKey: XAFGUEAYEMEVBG-AQTBWJFISA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H30-O2

Molecular Weight

  • 362.51
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • (Z)-2-(3,5-Di-tert-butyl-4-hydroxybenzylidene)-3,4-dihydro-(2H)naphthalen-1-one
  • BRN 4821009

Systematic Name

  • 1(2H)-Naphthalenone, 3,4-dihydro-2-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)-, (Z)-

Registry Numbers

CAS Registry Number

  • 137506-96-8

System Generated Number

  • 0137506968

Structure Descriptors

InChI

1S/C25H30O2/c1-24(2,3)20-14-16(15-21(23(20)27)25(4,5)6)13-18-12-11-17-9-7-8-10-19(17)22(18)26/h7-10,13-15,27H,11-12H2,1-6H3/b18-13-

InChIKey

XAFGUEAYEMEVBG-AQTBWJFISA-N

Smiles

CC(C)(C)c1cc(cc(c1O)C(C)(C)C)/C=C\2/CCc3ccccc3C2=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 247mg/kg (247mg/kg)   Drug and Chemical Toxicology. Vol. 13, Pg. 195, 1990.
rat LD oral > 2gm/kg (2000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 551, 1991.