Basic information
- Standard SMILES
C=C[C@](C)(COC(F)(F)F)C(=O)O- InChIKey
SAQGDMIUTIANHW-ZCFIWIBFSA-N- Molecular formula
- C7H9F3O3
- Average molar mass
- 198.14 g/mol
Names & identifiers
- Preferred name
- (R)-2-Methyl-2-trifluoromethoxymethyl-but-3-enoic acid
- IUPAC
- (2R)-2-methyl-2-(trifluoromethoxymethyl)but-3-enoic acid
Names & synonyms
(R)-2-Methyl-2-trifluoromethoxymethyl-but-3-enoic acidSCHEMBL16837741
Database identifiers
- PubChem CID
- 86706115
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 212
Related reactions
2 records
Compound notes
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