Butyrophenone, 4-(1-azaspiro(4.5)dec-1-yl)-4'-fluoro-
Basic information
- CAS
1093-11-4- Standard SMILES
O=C(CCCN1CCCC12CCCCC2)c1ccc(F)cc1- InChIKey
QPQPLSLLZVCHKN-UHFFFAOYSA-N- Molecular formula
- C19H26FNO
- Average molar mass
- 303.4 g/mol
- Monoisotopic mass
- 303.19984261
Names & identifiers
- Preferred name
- Butyrophenone, 4-(1-azaspiro(4.5)dec-1-yl)-4'-fluoro-
- IUPAC
- 4-(1-azaspiro[4.5]decan-1-yl)-1-(4-fluorophenyl)butan-1-one
Names & synonyms
1093-11-4BUTYROPHENONE, 4-(1-AZASPIRO(4.5)DEC-1-YL)-4'-FLUORO-RefChem:1080522BRN 14308184-(1-Azaspiro(4.5)dec-1-yl)-4'-fluoro-butyrophenoneDTXSID509110914-(1-azaspiro[4.5]decan-1-yl)-1-(4-fluorophenyl)butan-1-one
Database identifiers
- CAS
1093-11-4- PubChem CID
- 14174
- DTXSID
DTXSID50911091- Nikkaji
- J67.430C
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 370
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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