Basic information
- Standard SMILES
CCOS(=O)(=O)/C=C/C(C)C- InChIKey
PWQBDMAMDVLKEW-AATRIKPKSA-N- Molecular formula
- C7H14O3S
- Average molar mass
- 178.25 g/mol
Names & identifiers
- Preferred name
- Ethyl (E)-3-methylbut-1-ene-1-sulfonate
- IUPAC
- ethyl (E)-3-methylbut-1-ene-1-sulfonate
Names & synonyms
SCHEMBL27911786PWQBDMAMDVLKEW-AATRIKPKSA-NEthyl (E)-3-methylbut-1-ene-1-sulfonate
Database identifiers
- PubChem CID
- 13761995
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 208
Related reactions
1 records
Compound notes
Loading…