Basic information
- CAS
66902-50-9- Standard SMILES
CC(Cc1cccc[nH+]1)OC(=O)C(c1ccccc1)c1ccccc1.[Cl-]- InChIKey
DTJIRARZQAXUQM-UHFFFAOYSA-N- Molecular formula
- C22H22ClNO2
- Average molar mass
- 367.9 g/mol
- Monoisotopic mass
- 367.1339066
Names & identifiers
- Preferred name
- 1-(Pyridin-2-yl)propan-2-yl diphenylacetate--hydrogen chloride (1/1)
- IUPAC
- 1-pyridin-1-ium-2-ylpropan-2-yl 2,2-diphenylacetate chloride
Names & synonyms
66902-50-9DTXSID809855281-(Pyridin-2-yl)propan-2-yl diphenylacetate--hydrogen chloride (1/1)RefChem:1054760DTXCID701412720Diphenylacetic acid 1-methyl-2-(2-pyridyl)ethyl ester hydrochlorideACETIC ACID, DIPHENYL-, 1-METHYL-2-(2-PYRIDYL)ETHYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
66902-50-9- PubChem CID
- 48258
Properties
Computed structural properties
- Topological polar surface area
- 40.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 381
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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