[6-(2-Fluoro-phenyl)-pyridin-3-yloxy]-acetic acid tert-butyl ester
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Basic information
- Standard SMILES
CC(C)(C)OC(=O)COc1ccc(-c2ccccc2F)nc1- InChIKey
WPUQXVCDJPTNBB-UHFFFAOYSA-N- Molecular formula
- C17H18FNO3
- Average molar mass
- 303.33 g/mol
- Monoisotopic mass
- 303.1270716
Names & identifiers
- Preferred name
- [6-(2-Fluoro-phenyl)-pyridin-3-yloxy]-acetic acid tert-butyl ester
- IUPAC
- tert-butyl 2-[[6-(2-fluorophenyl)-3-pyridinyl]oxy]acetate
Names & synonyms
SCHEMBL3169981WPUQXVCDJPTNBB-UHFFFAOYSA-N[6-(2-Fluoro-phenyl)-pyridin-3-yloxy]-acetic acid tert-butyl ester
Database identifiers
- PubChem CID
- 68536675
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 369
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Related reactions
5 records
Compound notes
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