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Substance Name: 3-Cyanoalanine
RN: 923-01-3
InChIKey: BXRLWGXPSRYJDZ-UHFFFAOYSA-N

Molecular Formula

  • C4-H6-N2-O2

Molecular Weight

  • 114.1034
 
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Names and Synonyms

Name of Substance

  • 3-Cyanoalanine

Synonyms

  • 3-Cyanoalanine
  • BCNA
  • beta-Cyanoalanine
  • beta-Cyanolalanine
  • NSC 529055

Systematic Name

  • Alanine, 3-cyano-

Registry Numbers

CAS Registry Number

  • 923-01-3

System Generated Number

  • 0000923013

Structure Descriptors

InChI

1S/C4H6N2O2/c5-2-1-3(6)4(7)8/h3H,1,6H2,(H,7,8)

InChIKey

BXRLWGXPSRYJDZ-UHFFFAOYSA-N

Smiles

C(C#N)C(C(=O)O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 subcutaneous 134mg/kg (134mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Biochemical Pharmacology. Vol. 16, Pg. 2309, 1967.