5H-Dibenzo(a,d)cyclohepten-5-ol, 5-(2-(diethylamino)-1-methylethyl)-, hydrochloride

HCID 54093

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Basic information

CAS: 78110-14-2
Standard SMILES: CC[NH+](CC)CC(C)C1(O)c2ccccc2C=Cc2ccccc21.[Cl-]
InChIKey: KZVATFLDSDGNHV-UHFFFAOYSA-N
Molecular formula: C22H28ClNO
Average molar mass: 357.9 g/mol
Monoisotopic mass: 357.1859422

Names & identifiers

Preferred name: 5H-Dibenzo(a,d)cyclohepten-5-ol, 5-(2-(diethylamino)-1-methylethyl)-, hydrochloride
IUPAC: diethyl-[2-(2-hydroxy-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)propyl]azanium chloride

Names & synonyms

5H-Dibenzo(a,d)cyclohepten-5-ol, 5-(2-(diethylamino)-1-methylethyl)-, hydrochloride5-(2-(Diethylamino)-1-methylethyl)-5H-dibenzo(a,d)cyclohepten-5-ol hydrochloride78110-14-2RefChem:305531

Database identifiers

CAS: 78110-14-2
PubChem CID: 54093

Properties

Computed structural properties

Topological polar surface area: 24.7 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 5
Heavy atoms: 25
Formal charge: 0
Complexity: 402

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