1,3-Difluoro-2-propanol benzenesulfonate
Basic information
- CAS
882-71-3- Standard SMILES
O=S(=O)(OC(CF)CF)c1ccccc1- InChIKey
GSESOTRVUZZMII-UHFFFAOYSA-N- Molecular formula
- C9H10F2O3S
- Average molar mass
- 236.24 g/mol
- Monoisotopic mass
- 236.03187167
Names & identifiers
- Preferred name
- 1,3-Difluoro-2-propanol benzenesulfonate
- IUPAC
- 1,3-difluoropropan-2-yl benzenesulfonate
Names & synonyms
1,3-DIFLUORO-2-PROPANOL BENZENESULFONATE882-71-31,3-difluoropropan-2-yl benzenesulfonateDTXSID20236889
Database identifiers
- CAS
882-71-3- PubChem CID
- 13437
- DTXSID
DTXSID20236889- Nikkaji
- J1.566.171B
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 264
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Compound notes
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