D/L-Alanine | SBID = 1293 | Compound | Custom Molecule
Structure
Molecular Properties
| Interactions: | 12 | ||
| 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: | C3H7NO2 | ||
| M / g/mol: | 89.09318 | ||
| Complexity: | |||
| Number of Conformers: |
Identifiers
- Tags: typical guest, amino acid
- Name: D/L-Alanine
- Preferred Abbreviation: D/L-Ala
- IUPAC Name:
- CAS:
- CID: -439
- InChiKey: QNAYBMKLOCPYGJ-UHFFFAOYSA-N
- InChi: InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)
- CanoSmiles: CC(C(=O)O)N
- IsoSmiles: O=C(O)C(C)N
