Basic information
- CAS
106461-95-4- Standard SMILES
CCC(c1ccc(S(=O)(=O)[O-])cc1)C(C)CC(C)CC(C)C.[Na+]- InChIKey
HNZPMYGZDXYGOD-UHFFFAOYSA-M- Molecular formula
- C18H29NaO3S
- Average molar mass
- 348.5 g/mol
- Monoisotopic mass
- 348.17351024
Names & identifiers
- Preferred name
- Sodium 4-(4,6,8-trimethylnonan-3-yl)benzene-1-sulfonate
- IUPAC
- sodium 4-(4,6,8-trimethylnonan-3-yl)benzenesulfonate
Names & synonyms
DTXSID60880441106461-95-4Sodium 4-(4,6,8-trimethylnonan-3-yl)benzene-1-sulfonate
Database identifiers
- CAS
106461-95-4- PubChem CID
- 24906367
- DTXSID
DTXSID60880441
Properties
Computed structural properties
- Topological polar surface area
- 65.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 408
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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