Basic information
- CAS
6139-34-0- Standard SMILES
CCC1(c2ccccc2)CCCC(=O)N1- InChIKey
LPPKDHLXERDOIJ-UHFFFAOYSA-N- Molecular formula
- C13H17NO
- Average molar mass
- 203.28 g/mol
- Monoisotopic mass
- 203.13101417
Names & identifiers
- Preferred name
- 2-Piperidone, 6-ethyl-6-phenyl-
- IUPAC
- 6-ethyl-6-phenylpiperidin-2-one
Names & synonyms
2-Piperidone, 6-ethyl-6-phenyl-6139-34-0RefChem:10642126-Ethyl-6-phenyl-2-piperidoneBRN 01575385-21-08-00166 (Beilstein Handbook Reference)DTXSID909769426-Ethyl-6-phenyl-3,4,5,6-tetrahydropyridin-2-ol
Database identifiers
- CAS
6139-34-0- PubChem CID
- 201517
- DTXSID
DTXSID90976942
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 233
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…