L-Phenylalanine | SBID = 11 | Compound |
Structure
Molecular Properties
| Interactions: | 43 | ||
| PubChem TPSA/Å2: | 63.3 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -1.5 | ||
| 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): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 1.0 | ||
| 3D Volume/Å3: | 132.1 | ||
| Sum Formula: | C9H11NO2 | ||
| M / g/mol: | 165.192 | ||
| Complexity: | 153.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags: aromatic, typical guest, amino acid
- Name: L-Phenylalanine
- Preferred Abbreviation: L-Phe
- IUPAC Name: (2S)-2-amino-3-phenylpropanoic acid
- CAS: 63-91-2
- CID: 6140
- InChiKey: COLNVLDHVKWLRT-QMMMGPOBSA-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)/t8-/m0/s1
- CanoSmiles: C1=CC=C(C=C1)CC(C(=O)O)N
- IsoSmiles: C1=CC=C(C=C1)C[C@@H](C(=O)O)N
