Basic information
- CAS
506437-42-9- Standard SMILES
C=C(F)C(=O)c1ccc([N+](=O)[O-])cc1- InChIKey
QZNYYBZBUGNBTN-UHFFFAOYSA-N- Molecular formula
- C9H6FNO3
- Average molar mass
- 195.15 g/mol
- Monoisotopic mass
- 195.03317122
Names & identifiers
- Preferred name
- 2-Fluoro-1-(4-nitrophenyl)prop-2-en-1-one
- IUPAC
- 2-fluoro-1-(4-nitrophenyl)prop-2-en-1-one
- English name
- 2-Propen-1-one, 2-fluoro-1-(4-nitrophenyl)- (9CI)
- Molecular formula
- C9H6FNO3
- Molecular weight
- 195.15
Names & synonyms
2-fluoro-1-(4-nitrophenyl)prop-2-en-1-one506437-42-9DTXSID50458698RefChem:260809DTXCID80409517SCHEMBL28434025DB-2708652-Propen-1-one, 2-fluoro-1-(4-nitrophenyl)-2-Propen-1-one, 2-fluoro-1-(4-nitrophenyl)- (9CI)
Database identifiers
- CAS
506437-42-9- PubChem CID
- 11206363
- DTXSID
DTXSID50458698- Nikkaji
- J1.818.491E
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 264
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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