B-Cyano-L-Alanine

Molecule SVG Image

Properties Simple | Detailed

Formula C4H6N2O2
IUPAC Name (2s)-2-azaniumyl-3-cyano-propanoate
Molecular Mass 114.103 g·mol−1
Heat of Formation -267.9 ± 16.7 kJ·mol−1
Dipole Moment 2.90 ± 1.08 D
Volume 137.87 Å 3
Surface Area 145.8 Å 2
HOMO Energy -10.46 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-3-cyano-propanoic acid
  • (2s)-2-amino-3-cyano-propionic acid
  • (2s)-2-amino-3-cyanopropanoic acid
  • 3-cyano-l-alanine
  • beta-cyano-l-alanine
  • l-3-cyanoalanine
CAS Number(s)
  • 6232-19-5
InChIKey BXRLWGXPSRYJDZ-VKHMYHEASA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N