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Basic information
- Standard SMILES
O=C(OCCl)c1cc(F)cc(F)c1- InChIKey
MMPXUSYUHVLYRX-UHFFFAOYSA-N- Molecular formula
- C8H5ClF2O2
- Average molar mass
- 206.57 g/mol
- Monoisotopic mass
- 205.9946134
Names & identifiers
- Preferred name
- Chloromethyl 3,5-difluorobenzoate
- IUPAC
- chloromethyl 3,5-difluorobenzoate
Names & synonyms
SCHEMBL2338235chloromethyl 3,5-difluorobenzoateMMPXUSYUHVLYRX-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 59570331
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 179
Related reactions
3 records
Compound notes
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