4-[(3,4-Difluorophenyl)methylidene]-2-methyl-1,3-oxazol-5(4H)-one
Basic information
- CAS
182009-50-3- Standard SMILES
CC1=NC(=Cc2ccc(F)c(F)c2)C(=O)O1- InChIKey
OJWMIWZGTIBSDV-UHFFFAOYSA-N- Molecular formula
- C11H7F2NO2
- Average molar mass
- 223.17 g/mol
- Monoisotopic mass
- 223.04448479
Names & identifiers
- Preferred name
- 4-[(3,4-Difluorophenyl)methylidene]-2-methyl-1,3-oxazol-5(4H)-one
- IUPAC
- 4-[(3,4-difluorophenyl)methylidene]-2-methyl-1,3-oxazol-5-one
Names & synonyms
182009-50-34-[(3,4-Difluorophenyl)methylidene]-2-methyl-1,3-oxazol-5(4H)-one4-[(3,4-difluorophenyl)methylidene]-2-methyl-1,3-oxazol-5-oneDTXSID20724776
Database identifiers
- CAS
182009-50-3- PubChem CID
- 57370770
- DTXSID
DTXSID20724776
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 365
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…