Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzenemethanamine, alpha-phenyl-, 2-propylpentanoate
RN: 171507-36-1
InChIKey: KDAZPULOCHUOAZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H13-N.C8-H16-O2

Molecular Weight

  • 327.4651
 
* 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

Synonym

  • alpha-Phenylbenzenemethanamine 2-propylpentanoate

Systematic Name

  • Benzenemethanamine, alpha-phenyl-, 2-propylpentanoate

Registry Numbers

CAS Registry Number

  • 171507-36-1

System Generated Number

  • 0171507361

Molecular Formulas

Molecular Formula

  • C13-H13-N.C8-H16-O2

Molecular Formula Fragments

  • C13-H13-N
  • C8-H16-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C13H13N.C8H16O2/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-3-5-7(6-4-2)8(9)10/h1-10,13H,14H2;7H,3-6H2,1-2H3,(H,9,10)

InChIKey

KDAZPULOCHUOAZ-UHFFFAOYSA-N

Smiles

CCCC(CCC)C(=O)O.c1ccc(cc1)C(c2ccccc2)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1120mg/kg (1120mg/kg)   Pharmaceutical Chemistry Journal Vol. 28, Pg. 163, 1994.