(2S)-2-amino-3-phenylpropanoic acidhydrochloride | SBID = 2137 | Compound |
Structure
Molecular Properties
| Interactions: | 2 | ||
| PubChem TPSA/Å2: | 63.3 | ||
| Ertl TPSA/Å2: | 63.32 | ||
| Hydrophilicity (PubChem XLogP): | |||
| Hydrophilicity (Cheng XLogP3): | 0.37 | ||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 3.0 | ||
| 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: | |||
| Sum Formula: | C9H12ClNO2 | ||
| M / g/mol: | 201.65 | ||
| Complexity: | 153.0 | ||
| Number of Conformers: | 0.0 |
Identifiers
- Tags:
- Name: (2S)-2-amino-3-phenylpropanoic acidhydrochloride
- Preferred Abbreviation: Phenylalanine hydrochloride
- IUPAC Name: (2S)-2-amino-3-phenylpropanoic acid;hydrochloride
- CAS:
- CID: 12000150
- InChiKey: ZAIZDXVMSSDZFA-QRPNPIFTSA-N
- InChi: InChI=1S/C9H11NO2.ClH/c10-8(9(11)12)6-7-4-2-1-3-5-7;/h1-5,8H,6,10H2,(H,11,12);1H/t8-;/m0./s1
- CanoSmiles: C1=CC=C(C=C1)CC(C(=O)O)N.Cl
- IsoSmiles: C1=CC=C(C=C1)C[C@@H](C(=O)O)N.Cl
