Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride

HCID 46367

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Basic information

CAS: 64012-01-7
Standard SMILES: COc1ccccc1C[NH+](C)CCCl.[Cl-]
InChIKey: LBLYFTCYYCQVLG-UHFFFAOYSA-N
Molecular formula: C11H17Cl2NO
Average molar mass: 250.16 g/mol
Monoisotopic mass: 249.0687196

Names & identifiers

Preferred name: Benzylamine, N-(2-chloroethyl)-o-methoxy-N-methyl-, hydrochloride
IUPAC: 2-chloroethyl-[(2-methoxyphenyl)methyl]-methylazanium chloride

Names & synonyms

64012-01-7BENZYLAMINE, N-(2-CHLOROETHYL)-o-METHOXY-N-METHYL-, HYDROCHLORIDERefChem:1079514N-(2-Chloromethyl)-2-methoxy-N-methylbenzylamine hydrochlorideN-(2-Chloromethyl)-o-methoxy-N-methylbenzylamine hydrochloride

Database identifiers

CAS: 64012-01-7
PubChem CID: 46367

Properties

Computed structural properties

Topological polar surface area: 13.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 5
Heavy atoms: 15
Formal charge: 0
Complexity: 154

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