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Substance Name: Ethyl 3-cyanopropanoate
RN: 10137-67-4
UNII: Q745927X6R
InChIKey: BFSBTNGKMMFQNL-UHFFFAOYSA-N

Molecular Formula

  • C6-H9-N-O2

Molecular Weight

  • 127.142
 
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Names and Synonyms

Name of Substance

  • Ethyl 3-cyanopropanoate

Synonyms

  • 3-Cyanopropionic acid, ethyl ester
  • 4-02-00-01923 (Beilstein Handbook Reference)
  • BRN 1756022
  • NSC 94973
  • UNII-Q745927X6R

Systematic Names

  • Propanoic acid, 3-cyano-, ethyl ester (9CI)
  • Propionic acid, 3-cyano-, ethyl ester

Registry Numbers

CAS Registry Number

  • 10137-67-4

FDA UNII

  • Q745927X6R

System Generated Number

  • 0010137674

Structure Descriptors

InChI

1S/C6H9NO2/c1-2-9-6(8)4-3-5-7/h2-4H2,1H3

InChIKey

BFSBTNGKMMFQNL-UHFFFAOYSA-N

Smiles

N#CCCC(=O)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 10300uL/kg (10.3mL/kg)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.