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3',4'-Dimethoxyflavone

CAT: 0127-OR1025621-02Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1025621-02Size:250 mg
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CAS Number
4143-62-8
Synonyms
2- (3,4-dimethoxyphenyl) chromen-4-one
Purity
98%
Smiles
COC1=C(C=C(C=C1)C2=CC(=O)C3=CC=CC=C3O2)OC

Chemical Information

3',4'-Dimethoxyflavone

3',4'-dimethoxyflavone is an organic molecular entity.

CAS Number4143-62-8
PubChem CID688674
IUPAC Name2-(3,4-dimethoxyphenyl)chromen-4-one
Molecular FormulaC17H14O4
Molecular Weight282.29
XLogP3.5
Topological Polar Surface Area44.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity417
SMILES
COC1=C(C=C(C=C1)C2=CC(=O)C3=CC=CC=C3O2)OC
InChI
InChI=1S/C17H14O4/c1-19-15-8-7-11(9-17(15)20-2)16-10-13(18)12-5-3-4-6-14(12)21-16/h3-10H,1-2H3
InChIKey
ZGHORMOOTZTQFL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3',4'-Dimethoxyflavone
CAS: 4143-62-8
CID: 688674
Formula: C17H14O4
MW: 282.29
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight282.29
XLogP33.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass282.08920892
Monoisotopic Mass282.08920892
Topological Polar Surface Area44.8 Ų
Heavy Atom Count21
Formal Charge0
Complexity417
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes