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5,3',4'-Trihydroxyflavone (>85%)

CAT: 0572-TRC-T896685-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-T896685-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
19852-25-6
Hazard Statement
No Data Available
Smiles
Oc1ccc(cc1O)C2=CC(=O)c3c(O)cccc3O2
Molecular Formula
C15H10O5
Molecular Weight
270.24
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

5,3',4'-Trihydroxyflavone
CAS Number19852-25-6
PubChem CID88281
IUPAC Name2-(3,4-dihydroxyphenyl)-5-hydroxychromen-4-one
Molecular FormulaC15H10O5
Molecular Weight270.24
XLogP1.7
Topological Polar Surface Area87
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity418
SMILES
C1=CC(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C=C3)O)O)O
InChI
InChI=1S/C15H10O5/c16-9-5-4-8(6-11(9)18)14-7-12(19)15-10(17)2-1-3-13(15)20-14/h1-7,16-18H
InChIKey
KXPQYWKYYDYOCQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5,3',4'-Trihydroxyflavone
CAS: 19852-25-6
CID: 88281
Formula: C15H10O5
MW: 270.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight270.24
XLogP31.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass270.05282342
Monoisotopic Mass270.05282342
Topological Polar Surface Area87 Ų
Heavy Atom Count20
Formal Charge0
Complexity418
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

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OR1042326-011-Benzyl-3,5-dimethylpiperidin-4-one (cis:trans=85:15)
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