Basic information
- Standard SMILES
COC(=O)c1cc(OCC(O)CF)no1- InChIKey
RLXAJICGYBTWEG-UHFFFAOYSA-N- Molecular formula
- C8H10FNO5
- Average molar mass
- 219.17 g/mol
Names & identifiers
- Preferred name
- Methyl 3-(3-fluoro-2-hydroxypropoxy)isoxazole-5-carboxylate
- IUPAC
- methyl 3-(3-fluoro-2-hydroxypropoxy)-1,2-oxazole-5-carboxylate
Names & synonyms
SCHEMBL9113854RLXAJICGYBTWEG-UHFFFAOYSA-Nmethyl 3-(3-fluoro-2-hydroxypropoxy)isoxazole-5-carboxylate
Database identifiers
- PubChem CID
- 67778586
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 215
Related reactions
1 records
Compound notes
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