Basic information
- Standard SMILES
C=CCc1noc(COc2ccc(F)cc2Cl)n1- InChIKey
RSBXHVGUANOOQG-UHFFFAOYSA-N- Molecular formula
- C12H10ClFN2O2
- Average molar mass
- 268.67 g/mol
Names & identifiers
- Preferred name
- 3-Allyl-5-[(2-chloro-4-fluorophenoxy)methyl]-1,2,4-oxadiazole
- IUPAC
- 5-[(2-chloro-4-fluorophenoxy)methyl]-3-prop-2-enyl-1,2,4-oxadiazole
Names & synonyms
SCHEMBL9590765RSBXHVGUANOOQG-UHFFFAOYSA-N3-allyl-5-[(2-chloro-4-fluorophenoxy)methyl]-1,2,4-oxadiazole
Database identifiers
- PubChem CID
- 19797129
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 48.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 283
Related reactions
2 records
Compound notes
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