Basic information
- Standard SMILES
Cc1cc(OC(=O)c2ccccc2)no1- InChIKey
PQOGGHUXZNKAJU-UHFFFAOYSA-N- Molecular formula
- C11H9NO3
- Average molar mass
- 203.19 g/mol
Names & identifiers
- Preferred name
- 3-Benzoyloxy-5-methylisoxazole
- IUPAC
- (5-methyl-1,2-oxazol-3-yl) benzoate
Names & synonyms
3-benzoyloxy-5-methylisoxazoleSCHEMBL11366258PQOGGHUXZNKAJU-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 12415007
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 226
Related reactions
2 records
Compound notes
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