Basic information
- Standard SMILES
CCOC(=O)c1ncc(OC[C@H]2CC2(F)F)cc1F- InChIKey
NXSLPAYCPCFUIL-SSDOTTSWSA-N- Molecular formula
- C12H12F3NO3
- Average molar mass
- 275.22 g/mol
Names & identifiers
- Preferred name
- ethyl 5-(((1R)-2,2-difluorocyclopropyl)methoxy)-3-fluoropyridine-2-carboxylate
- IUPAC
- ethyl 5-[[(1R)-2,2-difluorocyclopropyl]methoxy]-3-fluoropyridine-2-carboxylate
Names & synonyms
ethyl 5-(((1R)-2,2-difluorocyclopropyl)methoxy)-3-fluoropyridine-2-carboxylateSCHEMBL15969071
Database identifiers
- PubChem CID
- 86731383
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 340
Related reactions
2 records
Compound notes
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