Basic information
- CAS
63905-83-9- Standard SMILES
CC1CC(OC(=O)C(c2ccccc2)c2ccccc2)CC(C)[NH+]1C.[Cl-]- InChIKey
LXYHHQBJIVTGNY-UHFFFAOYSA-N- Molecular formula
- C22H28ClNO2
- Average molar mass
- 373.9 g/mol
- Monoisotopic mass
- 373.1808568
Names & identifiers
- Preferred name
- Acetic acid, diphenyl-, 4-(1,2,6-trimethylpiperidyl)ester, hydrochloride
- IUPAC
- (1,2,6-trimethylpiperidin-1-ium-4-yl) 2,2-diphenylacetate chloride
Names & synonyms
ACETIC ACID, DIPHENYL-, 4-(1,2,6-TRIMETHYLPIPERIDYL)ESTER, HYDROCHLORIDE63905-83-9RefChem:1075802Diphenylacetic acid 1,2,6-trimethyl-4-piperidyl ester hydrochloride1,2,6-Trimethyl-4-piperidyl ester of diphenylacetic acid hydrochloride
Database identifiers
- CAS
63905-83-9- PubChem CID
- 45131
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 396
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…