6-Dimethylamino-4,4-diphenyl-3-heptanol hydrochloride
Basic information
- CAS
23164-36-5- Standard SMILES
CCC(O)C(CC(C)[NH+](C)C)(c1ccccc1)c1ccccc1.[Cl-]- InChIKey
GMNBUMFCZAZBQG-UHFFFAOYSA-N- Molecular formula
- C21H30ClNO
- Average molar mass
- 347.9 g/mol
- Monoisotopic mass
- 347.2015923
Overview
See also: Dimepheptanol hydrochloride (preferred).
Names & identifiers
- Preferred name
- 6-Dimethylamino-4,4-diphenyl-3-heptanol hydrochloride
- IUPAC
- (5-hydroxy-4,4-diphenylheptan-2-yl)-dimethylazanium chloride
Names & synonyms
Methadol hydrochlorideMethadol HClDimepheptanol HCl3-Heptanol, 6-(dimethylamino)-4,4-diphenyl-, hydrochlorideUNII-XZF6CW0CBCNSC 503846-Dimethylamino-4,4-diphenyl-3-heptanol hydrochloride3-HEPTANOL, 6-(N,N-DIMETHYLAMINO)-4,4-DIPHENYL-, HYDROCHLORIDE
Database identifiers
- CAS
23164-36-5- PubChem CID
- 31673
Properties
Computed structural properties
- Topological polar surface area
- 24.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 311
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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