Basic information
- CAS
6496-44-2- Standard SMILES
CC1=NOC(=O)C1=Cc1ccccc1F- InChIKey
BXUWIEXNQYEEAE-UHFFFAOYSA-N- Molecular formula
- C11H8FNO2
- Average molar mass
- 205.18 g/mol
- Monoisotopic mass
- 205.05390666
Names & identifiers
- Preferred name
- 4-[(2-Fluorophenyl)methylidene]-3-methyl-1,2-oxazol-5-one
- IUPAC
- 4-[(2-fluorophenyl)methylidene]-3-methyl-1,2-oxazol-5-one
Names & synonyms
6496-44-24-[(2-fluorophenyl)methylidene]-3-methyl-1,2-oxazol-5-oneDTXSID904095883-methyl-4-(2-fluorophenyl)methylene-isoxazole-5(4h)-one4-[(2-Fluorophenyl)methylidene]-3-methyl-1,2-oxazol-5(4H)-one
Database identifiers
- CAS
6496-44-2- PubChem CID
- 5202159
- DTXSID
DTXSID90409588
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 335
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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