Basic information
- CAS
64048-34-6- Standard SMILES
CC[N+](C)(CC)CCCOC(=O)C(O)(c1ccccc1)c1ccccc1.[Cl-]- InChIKey
VSGYTOKLSWSEPK-UHFFFAOYSA-M- Molecular formula
- C22H30ClNO3
- Average molar mass
- 391.9 g/mol
- Monoisotopic mass
- 391.1914215
Names & identifiers
- Preferred name
- Ammonium, (3-benziloyloxypropyl)diethylmethyl-, chloride
- IUPAC
- diethyl-[3-(2-hydroxy-2,2-diphenylacetyl)oxypropyl]-methylazanium chloride
Names & synonyms
Benzilyloxypropyldiethylmethylammonium chloride64048-34-6AMMONIUM, (3-BENZILOYLOXYPROPYL)DIETHYLMETHYL-, CHLORIDERefChem:318852E 8DTXSID70982268N,N-Diethyl-3-{[hydroxy(diphenyl)acetyl]oxy}-N-methylpropan-1-aminium chlorideN,N-Diethyl-3-{[hydroxydi(phenyl)acetyl]oxy}-N-methylpropan-1-aminium chloride
Database identifiers
- CAS
64048-34-6- PubChem CID
- 46764
- DTXSID
DTXSID70982268
Properties
Computed structural properties
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 403
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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