2,4-diaminobutanoate (protonated form) | SBID = 1488 | 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: | C5H11NO2 | ||
| M / g/mol: | 117.14634 | ||
| Complexity: | |||
| Number of Conformers: |
Identifiers
- Tags:
- Name: 2,4-diaminobutanoate (protonated form)
- Preferred Abbreviation: 2,4-diammoniumbutanoate
- IUPAC Name:
- CAS:
- CID: -567
- InChiKey: JJMDCOVWQOJGCB-UHFFFAOYSA-N
- InChi: InChI=1S/C5H11NO2/c6-4-2-1-3-5(7)8/h1-4,6H2,(H,7,8)
- CanoSmiles: [NH3+]CCCCC(=O)[O-]
- IsoSmiles: [NH3+]CCCCC([O-])=O
