Basic information
- CAS
67031-40-7- Standard SMILES
OC(C[NH+](Cc1ccccc1)Cc1ccccc1)c1ccccc1.[Cl-]- InChIKey
XRHNSYXWKBLPCK-UHFFFAOYSA-N- Molecular formula
- C22H24ClNO
- Average molar mass
- 353.9 g/mol
- Monoisotopic mass
- 353.1546421
Names & identifiers
- Preferred name
- Benzyl alcohol, alpha-(dibenzylaminomethyl)-, hydrochloride
- IUPAC
- dibenzyl-(2-hydroxy-2-phenylethyl)azanium chloride
Names & synonyms
67031-40-7BENZYL ALCOHOL, alpha-(DIBENZYLAMINOMETHYL)-, HYDROCHLORIDERefChem:1079451N-(beta-Hydroxyphenethyl)dibenzylamine hydrochloridealpha-(Dibenzylaminomethyl)benzyl alcohol hydrochlorideNSC 24540
Database identifiers
- CAS
67031-40-7- PubChem CID
- 48896
Properties
Computed structural properties
- Topological polar surface area
- 24.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 307
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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