Ethylamine, 2-((8-allyl-6-chloro-1,4-benzodioxan-5-yl)oxy)-N-methyl-, hydrochloride

HCID 58331

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 101418-22-8
Standard SMILES: C=CCc1cc(Cl)c(OCC[NH2+]C)c2c1OCCO2.[Cl-]
InChIKey: DHXFVPRPTURRTB-UHFFFAOYSA-N
Molecular formula: C14H19Cl2NO3
Average molar mass: 320.2 g/mol
Monoisotopic mass: 319.0741989

Names & identifiers

Preferred name: Ethylamine, 2-((8-allyl-6-chloro-1,4-benzodioxan-5-yl)oxy)-N-methyl-, hydrochloride
IUPAC: 2-[(6-chloro-8-prop-2-enyl-2,3-dihydro-1,4-benzodioxin-5-yl)oxy]ethyl-methylazanium chloride

Names & synonyms

Ethylamine, 2-((8-allyl-6-chloro-1,4-benzodioxan-5-yl)oxy)-N-methyl-, hydrochloride2-((8-Allyl-6-chloro-1,4-benzodioxan-5-yl)oxy)-N-methylethylamine hydrochloride101418-22-8RefChem:345102

Database identifiers

CAS: 101418-22-8
PubChem CID: 58331

Properties

Computed structural properties

Topological polar surface area: 44.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 6
Heavy atoms: 20
Formal charge: 0
Complexity: 290

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…