Basic information
- CAS
19340-13-7- Standard SMILES
CN1C(c2ccccc2)CC(=O)CC1(C)C- InChIKey
GMCQAJQFKVXPAT-UHFFFAOYSA-N- Molecular formula
- C14H19NO
- Average molar mass
- 217.31 g/mol
- Monoisotopic mass
- 217.14666423
Names & identifiers
- Preferred name
- 1,2,2-Trimethyl-6-phenylpiperidin-4-one
- IUPAC
- 1,2,2-trimethyl-6-phenylpiperidin-4-one
Names & synonyms
1,2,2-Trimethyl-6-phenylpiperidin-4-oneDTXSID4033784219340-13-7RefChem:214209DTXCID20288929GMCQAJQFKVXPAT-UHFFFAOYSA-N1,2,2-Trimethyl-6-phenyl-4-piperidinone #
Database identifiers
- CAS
19340-13-7- PubChem CID
- 545015
- DTXSID
DTXSID40337842
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 266
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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