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Flavone, 6-((diethylamino)methyl)-3-methyl-, monohydrochloride

HCID 27704
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Basic information

CAS
16146-79-5
Standard SMILES
CC[NH+](CC)Cc1ccc2oc(-c3ccccc3)c(C)c(=O)c2c1.[Cl-]
InChIKey
DRBFMPALKWTUTG-UHFFFAOYSA-N
Molecular formula
C21H24ClNO2
Average molar mass
357.9 g/mol
Monoisotopic mass
357.1495567

Names & identifiers

Preferred name
Flavone, 6-((diethylamino)methyl)-3-methyl-, monohydrochloride
IUPAC
diethyl-[(3-methyl-4-oxo-2-phenylchromen-6-yl)methyl]azanium chloride

Names & synonyms

Rec7-00526-(Diethylaminomethyl)-3-methyl-flavone hydrochloride16146-79-53-Metil-6-dietilamminometil-flavone-cloridrato [Italian]3-Metil-6-dietilamminometil-flavone-cloridratoFLAVONE, 6-((DIETHYLAMINO)METHYL)-3-METHYL-, MONOHYDROCHLORIDERefChem:345456

Database identifiers

CAS
16146-79-5
PubChem CID
27704

Properties

Computed structural properties

Topological polar surface area
30.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
25
Formal charge
0
Complexity
474

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