Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzenebutanoic acid, 4-cyclohexyl-gamma-oxo-
RN: 35288-13-2
InChIKey: QFDYKCAHHQKPSB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H20-O3

Molecular Weight

  • 260.331
 
* 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

  • 3-10-00-03204 (Beilstein Handbook Reference)
  • 4-Cyclohexyl-gamma-oxobenzenebutanoic acid
  • BRN 2419842
  • CB 965
  • EINECS 252-489-7

Systematic Names

  • 4-Cyclohexyl-gamma-oxobenzenebutyric acid
  • Benzenebutanoic acid, 4-cyclohexyl-gamma-oxo-

Registry Numbers

CAS Registry Number

  • 35288-13-2

System Generated Number

  • 0035288132

Structure Descriptors

InChI

1S/C16H20O3/c17-15(10-11-16(18)19)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H,18,19)

InChIKey

QFDYKCAHHQKPSB-UHFFFAOYSA-N

Smiles

c1(ccc(cc1)C1CCCCC1)C(CCC(=O)O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 24, Pg. 1360, 1974.