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6,7,4'-Trihydroxyflavanone

CAT: 0926-PHA68931-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0926-PHA68931-02Size:25 mg
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CAS Number
189689-31-4
Smiles
C1C (OC2=CC (=C (C=C2C1=O) O) O) C3=CC=C (C=C3) O
Molecular Formula
C15H12O5
Molecular Weight
272.25 g/mol
Controlled
No

Chemical Information

6,7,4'-Trihydroxyflavanone

6,7,4'-trihydroxyflavanone is a trihydroxyflavanone in which the three hydroxy substituents are located at positions 6, 7 and 4'. It is a member of 4'-hydroxyflavanones and a trihydroxyflavanone.

CAS Number189689-31-4
PubChem CID23724670
IUPAC Name6,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
Molecular FormulaC15H12O5
Molecular Weight272.25
XLogP1.8
Topological Polar Surface Area87
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity363
SMILES
C1C(OC2=CC(=C(C=C2C1=O)O)O)C3=CC=C(C=C3)O
InChI
InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)14-6-11(17)10-5-12(18)13(19)7-15(10)20-14/h1-5,7,14,16,18-19H,6H2
InChIKey
UABMFOBSIHSWFQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6,7,4'-Trihydroxyflavanone
CAS: 189689-31-4
CID: 23724670
Formula: C15H12O5
MW: 272.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight272.25
XLogP31.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass272.06847348
Monoisotopic Mass272.06847348
Topological Polar Surface Area87 Ų
Heavy Atom Count20
Formal Charge0
Complexity363
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
GTR191801996,7,4'-Trihydroxyflavanone
TN7858-017,2',4'-Trihydroxyflavanone
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MBS6031489-01Naringenin (4',5,7-Trihydroxyflavanone, Naringetol, Salipurpol)
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TRC-A579515-100MG4,4,5,5,6,6,7,7,7-Nonafluoroheptanoic Acid
sc-2268094,4,5,5,6,6,7,7,7-Nonafluoroheptyl iodide
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