Benzyl alcohol, 2,4-dichloro-alpha-(4-(2-(diethylamino)ethoxy)phenyl)-, hydrochloride

HCID 39249

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Basic information

CAS: 42740-30-7
Standard SMILES: CC[NH+](CC)CCOc1ccc(C(O)c2ccc(Cl)cc2Cl)cc1.[Cl-]
InChIKey: JRZRTMMXIPLXIW-UHFFFAOYSA-N
Molecular formula: C19H24Cl3NO2
Average molar mass: 404.8 g/mol
Monoisotopic mass: 403.087262

Names & identifiers

Preferred name: Benzyl alcohol, 2,4-dichloro-alpha-(4-(2-(diethylamino)ethoxy)phenyl)-, hydrochloride
IUPAC: 2-[4-[(2,4-dichlorophenyl)-hydroxymethyl]phenoxy]ethyl-diethylazanium chloride

Names & synonyms

Benzyl alcohol, 2,4-dichloro-alpha-(4-(2-(diethylamino)ethoxy)phenyl)-, hydrochloride2,4-Dichloro-alpha-(4-(2-(diethylamino)ethoxy)phenyl)benzenemethanol hydrochloride42740-30-7RefChem:328539

Database identifiers

CAS: 42740-30-7
PubChem CID: 39249

Properties

Computed structural properties

Topological polar surface area: 33.9 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 8
Heavy atoms: 25
Formal charge: 0
Complexity: 346

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