Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Hexanoic acid, 2-benzyl-2-(p-chlorophenyl)-, ethyl ester
RN: 2901-20-4
InChIKey: APANIFBWNHZMSZ-UHFFFAOYSA-N

Molecular Formula

  • C21-H25-Cl-O2

Molecular Weight

  • 344.879
 
* 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

  • 2-Benzyl-2-(p-chlorophenyl)hexanoic acid ethyl ester
  • BRN 2600590
  • NSC 85717

Systematic Name

  • Hexanoic acid, 2-benzyl-2-(p-chlorophenyl)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 2901-20-4

System Generated Number

  • 0002901204

Structure Descriptors

InChI

1S/C21H25ClO2/c1-3-5-15-21(20(23)24-4-2,16-17-9-7-6-8-10-17)18-11-13-19(22)14-12-18/h6-14H,3-5,15-16H2,1-2H3

InChIKey

APANIFBWNHZMSZ-UHFFFAOYSA-N

Smiles

c1([C@@](Cc2ccccc2)(C(OCC)=O)CCCC)ccc(Cl)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02883,