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7,8-Dihydroxy-4-phenylcoumarin

CAT: 0013-GTR19217289-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19217289-01Size:100 mg
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Description
7,8-Dihydroxy-4-phenylcoumarin inhibits the activity of Staphylococcus aureus DNA helicase.
CAS Number
842-01-3
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 100 mg/mL (393.33 mM)
Smiles
C1=CC=C (C=C1) C2=CC (=O) OC3=C2C=CC (=C3O) O
Molecular Formula
C15H10O4
Molecular Weight
254.24
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

4-Phenyl-7,8-dihydroxycoumarin

7,8-dihydroxy-4-phenyl-2H-chromen-2-one has been reported in Mesua ferrea with data available.

CAS Number842-01-3
PubChem CID5413034
IUPAC Name7,8-dihydroxy-4-phenylchromen-2-one
Molecular FormulaC15H10O4
Molecular Weight254.24
XLogP2.4
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count19
Formal Charge0
Complexity384
SMILES
C1=CC=C(C=C1)C2=CC(=O)OC3=C2C=CC(=C3O)O
InChI
InChI=1S/C15H10O4/c16-12-7-6-10-11(9-4-2-1-3-5-9)8-13(17)19-15(10)14(12)18/h1-8,16,18H
InChIKey
JRVIIPJSVKTPBK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Phenyl-7,8-dihydroxycoumarin
CAS: 842-01-3
CID: 5413034
Formula: C15H10O4
MW: 254.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight254.24
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass254.05790880
Monoisotopic Mass254.05790880
Topological Polar Surface Area66.8 Ų
Heavy Atom Count19
Formal Charge0
Complexity384
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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