Basic information
- CAS
102692-37-5- Standard SMILES
COc1ccc(C(=O)C=Cc2ccc(F)cc2)cc1- InChIKey
OAJAFWHLVBVKQH-UHFFFAOYSA-N- Molecular formula
- C16H13FO2
- Average molar mass
- 256.27 g/mol
- Monoisotopic mass
- 256.08995782
Names & identifiers
- Preferred name
- 3-(4-Fluorophenyl)-1-(4-methoxyphenyl)prop-2-en-1-one
- IUPAC
- 3-(4-fluorophenyl)-1-(4-methoxyphenyl)prop-2-en-1-one
Names & synonyms
3-(4-fluorophenyl)-1-(4-methoxyphenyl)prop-2-en-1-oneDTXSID50347371RefChem:274592DTXCID80298443102692-37-5SCHEMBL5470223AKOS030240551
Database identifiers
- CAS
102692-37-5- PubChem CID
- 620697
- DTXSID
DTXSID50347371
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 311
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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