6,2',4'-Trimethoxyflavone

CAT: 0024-sc-291423ASize: 50 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-291423ASize:50 mg

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CAS Number

720675-90-1

Chemical Information

6,2',4'-Trimethoxyflavone

structure in first source

CAS Number	720675-90-1
PubChem CID	688802
IUPAC Name	2-(2,4-dimethoxyphenyl)-6-methoxychromen-4-one
Molecular Formula	C18H16O5
Molecular Weight	312.3
XLogP	3.1
Topological Polar Surface Area	54
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	23
Formal Charge	0
Complexity	460

SMILES

COC1=CC2=C(C=C1)OC(=CC2=O)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C18H16O5/c1-20-11-5-7-16-14(8-11)15(19)10-18(23-16)13-6-4-12(21-2)9-17(13)22-3/h4-10H,1-3H3

InChIKey

WUWFDVDASNSUKP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 720675-90-1

CID: 688802

Formula: C18H16O5

MW: 312.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	312.3
XLogP3	3.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	312.09977361
Monoisotopic Mass	312.09977361
Topological Polar Surface Area	54 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	460
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-394243	5,6,7-Trimethoxyflavone
sc-276587B	3',5-Dihydroxy-4',6,7-trimethoxyflavone
sc-276587C	3',5-Dihydroxy-4',6,7-trimethoxyflavone
sc-276587A	3',5-Dihydroxy-4',6,7-trimethoxyflavone
sc-276587	3',5-Dihydroxy-4',6,7-trimethoxyflavone
sc-266679	3-Hydroxy-2',4',7-trimethoxyflavone
sc-276260	3-Hydroxy-4',7,8-trimethoxyflavone
sc-299063A	3-Hydroxy-2',7,8-trimethoxyflavone
sc-299063	3-Hydroxy-2',7,8-trimethoxyflavone
sc-223462	2,2,4,4,6,6-Hexamethylcyclotrisilazane