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3-HYDROXYFLAVONE

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3-HYDROXYFLAVONE Basic information

Product Name:
3-HYDROXYFLAVONE
Synonyms:
  • AURORA 20058
  • FLAVON-3-OL
  • TIMTEC-BB SBB000767
  • 3-hydroxy-2-phenyl-4h-1-benzopyran-4-on
  • 3-Hydroxy-2-phenyl-4H-chromen-4-one
  • 3-hydroxy-flavon
  • Flavone, 3-hydroxy-
  • FLAVONOL
CAS:
577-85-5
MF:
C15H10O3
MW:
238.24
EINECS:
209-416-9
Product Categories:
  • Inhibitors
  • Benzopyrans
  • Bioactive Small Molecules
  • Building Blocks
  • Cell Biology
  • Chemical Synthesis
  • Flavanols
  • Biochemistry
  • Flavonoids
  • H
  • Heterocyclic Building Blocks
Mol File:
577-85-5.mol
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3-HYDROXYFLAVONE Chemical Properties

Melting point:
171-172 °C (lit.)
Boiling point:
320.83°C (rough estimate)
Density 
1.2653 (rough estimate)
refractive index 
1.5740 (estimate)
storage temp. 
Inert atmosphere,Room Temperature
solubility 
DMSO: 1 mg/ml
pka
8.80±0.20(Predicted)
form 
powder to crystal
color 
White to Yellow to Green
Water Solubility 
Insoluble in water. Soluble in N,N-DMF and ethanol.
BRN 
15789
InChIKey
HVQAJTFOCKOKIN-UHFFFAOYSA-N
LogP
3.477 (est)
CAS DataBase Reference
577-85-5(CAS DataBase Reference)
EPA Substance Registry System
4H-1-Benzopyran-4-one, 3-hydroxy-2-phenyl- (577-85-5)
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Safety Information

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
26-37/39
WGK Germany 
3
RTECS 
LK8650000
Hazard Note 
Irritant
TSCA 
Yes
HS Code 
29322090
Hazardous Substances Data
577-85-5(Hazardous Substances Data)

MSDS

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3-HYDROXYFLAVONE Usage And Synthesis

Chemical Properties

yellow fluffy powder

Uses

Reactant involved in:• ;Studies of photochemically-induced dioxygenase-type CO-release reactivity1• ;Phase-transfer protection and deprotection of hydroxychromones2• ;O-methylation with di-Me carbonate3Reactant involved in the synthesis of biologically active molecules including:• ;2-Chloropyridine derivatives for studies of antitumor agents and telomerase inhibitors4• ;Dihydrochromenopyrazines and chromenoquinoxalines5Involved in studies of its electrochemical properties using voltammetric methodologies6

Uses

3-Hydroxyflavone is a reactant involved in studies of photochemically-induced dioxygenase-type CO-release reactivity; phase-transfer protection and deprotection of hydroxychromones; and O-methylation with di-Me carbonate. As a reactant it is involved in the synthesis of biologically active molecules including 2-chloropyridine derivatives for studies of antitumor agents and telomerase inhibitors; dihydrochromenopyrazines and chromenoquinoxalines. It is also involved in studies of its electrochemical properties using voltammetric methodologies.

Definition

ChEBI: A monohydroxyflavone that is the 3-hydroxy derivative of flavone.

Synthesis Reference(s)

Tetrahedron Letters, 25, p. 5561, 1984 DOI: 10.1016/S0040-4039(01)81626-9

Purification Methods

Recrystallise it from MeOH (m 169.5-170o), EtOH, aqueous EtOH (m 167o) or hexane. It has also been purified by repeated sublimation under high vacuum, and dried at high vacuum pumping for at least one hour [Bruker & Kelly J Phys Chem 91 2856 1987]. [Beilstein 17 H 527, 17 I 268, 17 II 498, 17 III/IV 6428.]

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