4-Hydroxybutyl L-Phenylalaninate

Molecule SVG Image

Properties Simple | Detailed

Formula C13H19NO3
IUPAC Name 4-hydroxybutyl (2s)-2-amino-3-phenyl-propanoate
Molecular Mass 237.295 g·mol−1
Heat of Formation -536.0 ± 16.7 kJ·mol−1
Dipole Moment 1.21 ± 1.08 D
Volume 305.8 Å 3
Surface Area 257.54 Å 2
HOMO Energy -9.74 ± 0.55 eV
LUMO Energy -0.04 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-3-phenyl-propionic acid 4-hydroxybutyl ester
  • (2s)-2-amino-3-phenylpropanoic acid 4-hydroxybutyl ester
  • 4-hydroxybutyl (2s)-2-amino-3-phenyl-propanoate
  • 4-hydroxybutyl (2s)-2-amino-3-phenylpropanoate
  • l-phenylalanine, 4-hydroxybutyl ester
  • phe-hbe
  • phenylalanine 4-hydroxybutyl ester
CAS Number(s)
  • 136680-70-1
InChIKey RPIZQTCVTPOZFI-LBPRGKRZSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N