Basic information
- CAS
64-64-2- Standard SMILES
O=C(CCCN1CCC2(CCCC2)CC1)c1ccc(F)cc1- InChIKey
FYSKJBITNYKPBE-UHFFFAOYSA-N- Molecular formula
- C19H26FNO
- Average molar mass
- 303.4 g/mol
- Monoisotopic mass
- 303.19984261
Names & identifiers
- Preferred name
- Butyrophenone, 4-(8-azaspiro(4.5)dec-8-yl)-4'-fluoro-
- IUPAC
- 4-(8-azaspiro[4.5]decan-8-yl)-1-(4-fluorophenyl)butan-1-one
Names & synonyms
64-64-2BUTYROPHENONE, 4-(8-AZASPIRO(4.5)DEC-8-YL)-4'-FLUORO-4-(8-Azaspiro(4.5)dec-8-yl)-4'-fluoro-butyrophenoneDTXSID90213980RefChem:331473DTXCID201364714-(8-azaspiro[4.5]decan-8-yl)-1-(4-fluorophenyl)butan-1-oneSCHEMBL17204206
Database identifiers
- CAS
64-64-2- PubChem CID
- 6161
- DTXSID
DTXSID90213980- Nikkaji
- J67.432J
Properties
Computed structural properties
- XLogP
- 4.6
- 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
- 360
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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