D/L-phenylalanine | SBID = 1297 | Compound | Custom Molecule

Molecular Properties

Interactions: 13
PubChem TPSA/Å2:
Ertl TPSA/Å2:
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3):
Charge: 0.0
Number of H-Bond Donors: 2.0
Number of H-Bond Acceptors: 3.0
Number of Stereogenic Bonds (E/Z):
Number of Stereogenic Atoms (R/S):
3D Volume/Å3:
Sum Formula: C9H11NO2
M / g/mol: 165.18914
Complexity:
Number of Conformers:

Identifiers

  • Tags: aromatic, amino acid, typical guest
  • Name: D/L-phenylalanine
  • Preferred Abbreviation: D/L-Phe
  • IUPAC Name:
  • CAS:
  • CID: -443
  • InChiKey: COLNVLDHVKWLRT-UHFFFAOYSA-N
  • InChi: InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)
  • CanoSmiles: NC(C(=O)O)Cc1ccccc1
  • IsoSmiles: O=C(O)C(CC1=CC=CC=C1)N