Dimethyltetradecylsulphonium methyl sulphate
Basic information
- CAS
79762-45-1- Standard SMILES
CCCCCCCCCCCCCC[S+](C)C.COS(=O)(=O)[O-]- InChIKey
PNLKJHBHBRSHQN-UHFFFAOYSA-M- Molecular formula
- C17H38O4S2
- Average molar mass
- 370.6 g/mol
- Monoisotopic mass
- 370.22115204
Names & identifiers
- Preferred name
- Dimethyltetradecylsulphonium methyl sulphate
- IUPAC
- dimethyl(tetradecyl)sulfanium;methyl sulfate
- English name
- dimethyltetradecylsulphonium methyl sulphate
- Molecular formula
- C17H38O4S2
- Molecular weight
- 370.61122
Names & synonyms
79762-45-1Dimethyltetradecylsulphonium methyl sulphateEINECS 279-253-6SCHEMBL10625216PNLKJHBHBRSHQN-UHFFFAOYSA-MDTXSID101000717Dimethyl(tetradecyl)sulfanium methyl sulfateNS00061040
Database identifiers
- CAS
79762-45-1- PubChem CID
- 20134162
- DTXSID
DTXSID101000717- EC Number
- 279-253-6
Properties
Computed structural properties
- Topological polar surface area
- 75.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 222
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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