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Mesylate | SBID = 1812 | Compound | Custom Molecule
Structure
Molecular Properties
| Interactions: | 5 | ||
| PubChem TPSA/Å2: | |||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | |||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | -1.0 | ||
| Number of H-Bond Donors: | 0.0 | ||
| Number of H-Bond Acceptors: | 3.0 | ||
| Number of Stereogenic Bonds (E/Z): | |||
| Number of Stereogenic Atoms (R/S): | |||
| 3D Volume/Å3: | |||
| Sum Formula: | CH3O3S- | ||
| M / g/mol: | 95.09772 | ||
| Complexity: | |||
| Number of Conformers: |
Identifiers
- Tags: anion, typical guest, charged
- Name: Mesylate
- Preferred Abbreviation: Mesylate
- IUPAC Name:
- CAS:
- CID: -738
- InChiKey: AFVFQIVMOAPDHO-UHFFFAOYSA-M
- InChi: InChI=1S/CH4O3S/c1-5(2,3)4/h1H3,(H,2,3,4)/p-1
- CanoSmiles: [O-]S(=O)(=O)C
- IsoSmiles: CS(=O)([O-])=O
