Octadec-9-ene-1-sulfonic acid
Basic information
- CAS
793603-40-4- Standard SMILES
CCCCCCCCC=CCCCCCCCCS(=O)(=O)O- InChIKey
XQKYXKGDNYKVTR-UHFFFAOYSA-N- Molecular formula
- C18H36O3S
- Average molar mass
- 332.5 g/mol
- Monoisotopic mass
- 332.23851618
Names & identifiers
- Preferred name
- Octadec-9-ene-1-sulfonic acid
- IUPAC
- octadec-9-ene-1-sulfonic acid
Names & synonyms
octadec-9-ene-1-sulfonic acidSCHEMBL2219389DTXSID90860150793603-40-4
Database identifiers
- CAS
793603-40-4- PubChem CID
- 84779
- DTXSID
DTXSID90860150
Properties
Computed structural properties
- XLogP
- 7
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 16
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 342
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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