gamma-Aminobutanoate (protonated form) | SBID = 1486 | Compound | Custom Molecule
Structure
Molecular Properties
| Interactions: | 1 | ||
| 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: | C4H9NO2 | ||
| M / g/mol: | 103.11976 | ||
| Complexity: | |||
| Number of Conformers: |
Identifiers
- Tags:
- Name: gamma-Aminobutanoate (protonated form)
- Preferred Abbreviation: 4-ammoniumbutanoate
- IUPAC Name:
- CAS:
- CID: -566
- InChiKey: BTCSSZJGUNDROE-UHFFFAOYSA-N
- InChi: InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)
- CanoSmiles: [NH3+]CCCC(=O)[O-]
- IsoSmiles: [NH3+]CCCC([O-])=O
