2-(Dimethylamino)ethyl 2-(2-phenylethyl)benzoate--hydrogen chloride (1/1)

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Basic information

CAS: 14188-01-3
Standard SMILES: C[NH+](C)CCOC(=O)c1ccccc1CCc1ccccc1.[Cl-]
InChIKey: CDGCTSKZNMCTMH-UHFFFAOYSA-N
Molecular formula: C19H24ClNO2
Average molar mass: 333.8 g/mol
Monoisotopic mass: 333.1495567

Names & identifiers

Preferred name: 2-(Dimethylamino)ethyl 2-(2-phenylethyl)benzoate--hydrogen chloride (1/1)
IUPAC: dimethyl-[2-[2-(2-phenylethyl)benzoyl]oxyethyl]azanium chloride

Names & synonyms

14188-01-3DTXSID709312312-(Dimethylamino)ethyl 2-(2-phenylethyl)benzoate--hydrogen chloride (1/1)RefChem:1061783DTXCID801359943o-Phenethylbenzoic acid 2-(dimethylamino)ethyl ester hydrochlorideBENZOIC ACID, o-PHENETHYL-, 2-(DIMETHYLAMINO)ETHYL ESTER, HYDROCHLORIDE

Database identifiers

CAS: 14188-01-3
PubChem CID: 26542

Properties

Computed structural properties

Topological polar surface area: 30.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 8
Heavy atoms: 23
Formal charge: 0
Complexity: 323

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Compound notes

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