sodium;butane-1-sulfonate | SBID = 2703 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 65.6 | ||
| Ertl TPSA/Å2: | 57.2 | ||
| Hydrophilicity (PubChem XLogP): | |||
| Hydrophilicity (Cheng XLogP3): | 0.36 | ||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 0.0 | ||
| Number of H-Bond Acceptors: | 3.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | |||
| Sum Formula: | C4H9NaO3S | ||
| M / g/mol: | 160.17 | ||
| Complexity: | 134.0 | ||
| Number of Conformers: | 0.0 |
Identifiers
- Tags: surfactant, typical guest
- Name: sodium;butane-1-sulfonate
- Preferred Abbreviation: sodium 1-butanesulfonate
- IUPAC Name: sodium;butane-1-sulfonate
- CAS: 2386-54-1
- CID: 4096517
- InChiKey: XQCHMGAOAWZUPI-UHFFFAOYSA-M
- InChi: InChI=1S/C4H10O3S.Na/c1-2-3-4-8(5,6)7;/h2-4H2,1H3,(H,5,6,7);/q;+1/p-1
- CanoSmiles: CCCCS(=O)(=O)[O-].[Na+]
- IsoSmiles: CCCCS(=O)(=O)[O-].[Na+]
