Basic information
- Standard SMILES
OCC1COC(C(F)(F)F)(C(F)(F)F)O1- InChIKey
OYKGKOJMJWRHPS-UHFFFAOYSA-N- Molecular formula
- C6H6F6O3
- Average molar mass
- 240.1 g/mol
- Monoisotopic mass
- 240.02211302
Names & identifiers
- Preferred name
- 2,2-Bis(trifluoromethyl)-4-hydroxymethyl-1,3-dioxolane
- IUPAC
- [2,2-bis(trifluoromethyl)-1,3-dioxolan-4-yl]methanol
Names & synonyms
2,2-bis(trifluoromethyl)-4-hydroxymethyl-1,3-dioxolaneSCHEMBL7079823
Database identifiers
- PubChem CID
- 21997103
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 220
Related reactions
10 records
Compound notes
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