β-Alanine, N-butyl-, methyl ester

CAS Registry Number®

4640-77-1
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CAS Name

β-Alanine, N-butyl-, methyl ester

Molecular Formula

C8H17NO2

Molecular Mass

159.23

Cite this Page

β-Alanine, N-butyl-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4640-77-1 (retrieved 2024-09-19) (CAS RN: 4640-77-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    75 °C @ Press: 5 Torr

  • Density (2)

    0.9268 g/cm³ @ Temp: 21 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H17NO2/c1-3-4-6-9-7-5-8(10)11-2/h9H,3-7H2,1-2H3

InChIKey

InChIKey=JUXSDNMTSOPPRW-UHFFFAOYSA-N

SMILES

C(CC(OC)=O)NCCCC

Canonical SMILES

O=C(OC)CCNCCCC

Other Names for this Substance

  • β-Alanine, N-butyl-, methyl ester
  • Methyl β-(n-butylamino)propionate
  • Methyl 3-(butylamino)propionate
  • N-Butyl-β-alanine methyl ester