Basic information
- Standard SMILES
CC(C)CCCCCCCOC(=O)CC(C(=O)O)S(=O)(=O)O- InChIKey
RHHCQDXPRDOJNA-UHFFFAOYSA-N- Molecular formula
- C14H26O7S
- Average molar mass
- 338.42 g/mol
- Monoisotopic mass
- 338.13992417
Names & identifiers
- Preferred name
- Isodecyl sulfosuccinic acid
- IUPAC
- 4-(8-methylnonoxy)-4-oxo-2-sulfobutanoic acid
Names & synonyms
Isodecyl sulfosuccinic acidDTXSID9044293SCHEMBL287913734-[(8-Methylnonyl)oxy]-4-oxo-2-sulfobutanoic acid
Database identifiers
- PubChem CID
- 15748522
- DTXSID
DTXSID9044293
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 13
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 437
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…