Basic information
- Standard SMILES
COC(=O)c1ccc(OC[C@H]2CC2(F)F)cc1- InChIKey
FTUYHTQSSQLJMC-SECBINFHSA-N- Molecular formula
- C12H12F2O3
- Average molar mass
- 242.22 g/mol
Names & identifiers
- Preferred name
- methyl 4-(((1R)-2,2-difluorocyclopropyl)methoxy)benzoate
- IUPAC
- methyl 4-[[(1R)-2,2-difluorocyclopropyl]methoxy]benzoate
Names & synonyms
methyl 4-(((1R)-2,2-difluorocyclopropyl)methoxy)benzoateSCHEMBL15968878
Database identifiers
- PubChem CID
- 86731369
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 285
Related reactions
2 records
Compound notes
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