bisulfate | SBID = 2112 | Compound | Custom Molecule
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | |||
| Ertl TPSA/Å2: | 77.43 | ||
| Hydrophilicity (PubChem XLogP): | |||
| Hydrophilicity (Cheng XLogP3): | -1.38 | ||
| Charge: | -1.0 | ||
| Number of H-Bond Donors: | |||
| Number of H-Bond Acceptors: | |||
| Number of Stereogenic Bonds (E/Z): | |||
| Number of Stereogenic Atoms (R/S): | |||
| 3D Volume/Å3: | |||
| Sum Formula: | HO4S- | ||
| M / g/mol: | 97.07054 | ||
| Complexity: | |||
| Number of Conformers: |
Identifiers
- Tags:
- Name: bisulfate
- Preferred Abbreviation: hydrogensulfate
- IUPAC Name: hydrogen sulfate
- CAS: 14996-02-2
- CID: -926
- InChiKey: QAOWNCQODCNURD-UHFFFAOYSA-M
- InChi: InChI=1S/H2O4S/c1-5(2,3)4/h(H2,1,2,3,4)/p-1
- CanoSmiles: [O-]S(=O)(=O)O
- IsoSmiles: OS([O-])(=O)=O
