Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzeneacetic acid, alpha-ethyl-4-nitro- (9CI)
RN: 7463-53-8
InChIKey: XBGNOMBPRQVJSR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H11-N-O4

Molecular Weight

  • 209.2
 
* 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-(p-Nitrophenyl)butyric acid
  • alpha-Ethyl-4-nitrobenzeneacetic acid
  • EINECS 231-256-3
  • NSC 404387
  • NSC 68215

Systematic Names

  • 2-(4-Nitrophenyl)butyric acid
  • Benzeneacetic acid, alpha-ethyl-4-nitro- (9CI)
  • Butyric acid, 2-(p-nitrophenyl)-

Registry Numbers

CAS Registry Number

  • 7463-53-8

System Generated Number

  • 0007463538

Structure Descriptors

InChI

1S/C10H11NO4/c1-2-9(10(12)13)7-3-5-8(6-4-7)11(14)15/h3-6,9H,2H2,1H3,(H,12,13)

InChIKey

XBGNOMBPRQVJSR-UHFFFAOYSA-N

Smiles

c1([C@@H](C(O)=O)CC)ccc([N+](=O)[O-])cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 240mg/kg (240mg/kg)   Farmaco, Edizione Scientifica. Vol. 13, Pg. 286, 1958.