Chromone, 2,3-dimethyl-7-methoxy-8-(morpholinomethyl)-, hydrochloride

HCID 45567

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Basic information

CAS: 63938-21-6
Standard SMILES: COc1ccc2c(=O)c(C)c(C)oc2c1C[NH+]1CCOCC1.[Cl-]
InChIKey: HKMYUTZXBNCDAN-UHFFFAOYSA-N
Molecular formula: C17H22ClNO4
Average molar mass: 339.8 g/mol
Monoisotopic mass: 339.1237359

Names & identifiers

Preferred name: Chromone, 2,3-dimethyl-7-methoxy-8-(morpholinomethyl)-, hydrochloride
IUPAC: 7-methoxy-2,3-dimethyl-8-(morpholin-4-ium-4-ylmethyl)chromen-4-one chloride

Names & synonyms

Chromone, 7-hydroxy-2,3-dimethyl-8-(morpholinomethyl)-, hydrochloride4H-1-Benzopyran-4-one, 7-methoxy-2,3-dimethyl-8-(4-morpholinylmethyl)-, hydrochloride2,3-Dimethyl-7-methoxy-8-(morpholinomethyl)chromone hydrochlorideCHROMONE, 2,3-DIMETHYL-7-METHOXY-8-(MORPHOLINOMETHYL)-, HYDROCHLORIDE63938-21-6RefChem:334053

Database identifiers

CAS: 63938-21-6
PubChem CID: 45567

Properties

Computed structural properties

Topological polar surface area: 49.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 3
Heavy atoms: 23
Formal charge: 0
Complexity: 456

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