Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzenepropanoic acid, alpha-(2-carboxyphenyl)-
RN: 2897-88-3
InChIKey: RYFBBLZNOYCNFY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H14-O4

Molecular Weight

  • 270.283
 
* 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

  • 3-09-00-04536 (Beilstein Handbook Reference)
  • alpha-(2-Carboxyphenyl)benzenepropanoic acid
  • BRN 2057576

Systematic Name

  • Benzenepropanoic acid, alpha-(2-carboxyphenyl)-

Registry Numbers

CAS Registry Number

  • 2897-88-3

System Generated Number

  • 0002897883

Structure Descriptors

InChI

1S/C16H14O4/c17-15(18)13-9-5-4-8-12(13)14(16(19)20)10-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,17,18)(H,19,20)

InChIKey

RYFBBLZNOYCNFY-UHFFFAOYSA-N

Smiles

c1(ccccc1)C[C@@H](C(=O)O)c1c(cccc1)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 383mg/kg (383mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 17, Pg. 496, 1979.