Benzhydrol, alpha-(2-(diethylamino)-1-(isobutoxymethyl)ethyl)-, hydrochloride
Basic information
- CAS
27674-48-2- Standard SMILES
CCN(CC)CC(COCC(C)C)C(O)(c1ccccc1)c1ccccc1.Cl- InChIKey
AOLYHGJOCAFUAJ-UHFFFAOYSA-N- Molecular formula
- C24H36ClNO2
- Average molar mass
- 406 g/mol
- Monoisotopic mass
- 405.2434571
Names & identifiers
- Preferred name
- Benzhydrol, alpha-(2-(diethylamino)-1-(isobutoxymethyl)ethyl)-, hydrochloride
- IUPAC
- 2-(diethylaminomethyl)-3-(2-methylpropoxy)-1,1-diphenylpropan-1-ol;hydrochloride
Names & synonyms
27674-48-2alpha-(2-(Diethylamino)-1-(isobutoxymethyl)ethyl)benzhydrol hydrochlorideBenzhydrol, alpha-(2-(diethylamino)-1-(isobutoxymethyl)ethyl)-, hydrochlorideN,N-Diethyl-(3-isobutoxy-2-(diphenyl-hydroxy)methyl)propylamine hydrochlorideBenzenemethanol, alpha-((2-(diethylamino)-1-(2-methylpropoxy)methyl)ethyl)-alpha-phenyl-, HClRefChem:325705DTXSID109503202-[(Diethylamino)methyl]-3-(2-methylpropoxy)-1,1-diphenylpropan-1-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
27674-48-2- PubChem CID
- 214064
- DTXSID
DTXSID10950320
Properties
Computed structural properties
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 364
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Compound notes
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