Basic information
- CAS
42023-68-7- Standard SMILES
O=C(OCc1cccc[nH+]1)C(c1ccccc1)c1ccccc1.[Cl-]- InChIKey
HPZSJXFPOLMSFY-UHFFFAOYSA-N- Molecular formula
- C20H18ClNO2
- Average molar mass
- 339.8 g/mol
- Monoisotopic mass
- 339.1026065
Names & identifiers
- Preferred name
- (Pyridin-2-yl)methyl diphenylacetate--hydrogen chloride (1/1)
- IUPAC
- pyridin-1-ium-2-ylmethyl 2,2-diphenylacetate chloride
Names & synonyms
42023-68-7DTXSID50962205(Pyridin-2-yl)methyl diphenylacetate--hydrogen chloride (1/1)RefChem:1051040DTXCID6013900182-Pyridylmethyl diphenylacetate hydrochlorideF 1173Methanol, 2-pyridyl-, diphenylacetate, hydrochlorideACETIC ACID, DIPHENYL-, 2-PYRIDYLMETHYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
42023-68-7- PubChem CID
- 39093
Properties
Computed structural properties
- Topological polar surface area
- 40.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 341
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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