Basic information
- CAS
4476-25-9- Standard SMILES
O=C(CCCN1CCCCC1)c1ccccc1- InChIKey
WLTFPYVGECWXFO-UHFFFAOYSA-N- Molecular formula
- C15H21NO
- Average molar mass
- 231.33 g/mol
- Monoisotopic mass
- 231.16231429
Names & identifiers
- Preferred name
- 1-Butanone, 1-phenyl-4-(1-piperidinyl)-
- IUPAC
- 1-phenyl-4-piperidin-1-ylbutan-1-one
- English name
- 1-phenyl-4-(1-piperidyl)butan-1-one
- Molecular formula
- C15H21NO
- Molecular weight
- 231.33
Names & synonyms
4-Piperidinobutyrophenone4476-25-93'-(1-Piperidyl)butyrophenoneBRN 0167020BUTYROPHENONE, 4-PIPERIDINO-1-Butanone, 1-phenyl-4-(1-piperidinyl)-DTXSID201962975-20-02-00354 (Beilstein Handbook Reference)RefChem:228887DTXCID301187881-Butanone, 1-phenyl-4-(1-piperidinyl)-(9CI)1-PHENYL-4-(PIPERIDIN-1-YL)BUTAN-1-ONE
Show more names
1-phenyl-4-(1-piperidyl)butan-1-one
1-Butanone, 1-phenyl-4-(1-piperidinyl)- (9CI)SCHEMBL7388601SCHEMBL7645836WLTFPYVGECWXFO-UHFFFAOYSA-NAKOS0090578041-phenyl-4-(1-piperidinyl)butan-1-one
Database identifiers
- CAS
4476-25-9- PubChem CID
- 20554
- DTXSID
DTXSID20196297- Nikkaji
- J67.486I
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 227
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
1 records
Compound notes
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