1-Butanone, 4-(1,3-dioxa-9-azaspiro(5.5)undec-9-yl)-1-(4-fluorophenyl)-, Hydrochloride
Basic information
- CAS
63377-07-1- Standard SMILES
O=C(CCC[NH+]1CCC2(CCOCO2)CC1)c1ccc(F)cc1.[Cl-]- InChIKey
QEWCPLIKDYFAEY-UHFFFAOYSA-N- Molecular formula
- C18H25ClFNO3
- Average molar mass
- 357.8 g/mol
- Monoisotopic mass
- 357.1506995
Names & identifiers
- Preferred name
- 1-Butanone, 4-(1,3-dioxa-9-azaspiro(5.5)undec-9-yl)-1-(4-fluorophenyl)-, Hydrochloride
- IUPAC
- 4-(1,3-dioxa-9-azoniaspiro[5.5]undecan-9-yl)-1-(4-fluorophenyl)butan-1-one chloride
Names & synonyms
1,3-Dioxa-9-azaspiro(5.5)undecane, 9-(3-(p-fluorobenzoyl)propyl)-, hydrochloride63377-07-11-Butanone, 4-(1,3-dioxa-9-azaspiro(5.5)undec-9-yl)-1-(4-fluorophenyl)-, HydrochlorideBUTYROPHENONE, 4-(1,3-DIOXA-9-AZASPIRO(5.5)UNDEC-9-YL)-4'-FLUORO-, HYDROCHLORIDERefChem:2289131-Butanone, 4-(1,3-dioxa-9-azaspiro(5.5)undec-9-yl)-1-(4-fluorophenyl)-, Hydrochloride (9CI)
Database identifiers
- CAS
63377-07-1- PubChem CID
- 44469
Properties
Computed structural properties
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 388
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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