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2,4,4'-Trihydroxydihydrochalcone

CAT: 0804-HY-N8786Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N8786Size:1 mg
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Description
2,4,4'-Trihydroxydihydrochalcone is a Chalcones product that can be isolated from the resin of Dracaena draco.[1].
CAS Number
15097-74-2
UNSPSC
12352005
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/2-4-4-trihydroxydihydrochalcone.html
Purity
95
Smiles
O=C(C1=CC=C(O)C=C1)CCC2=CC=C(O)C=C2O
Molecular Formula
C15H14O4
Molecular Weight
258.27
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light)
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

2,4,4'-Trihydroxydihydrochalcone

2,4,4'-trihydroxydihydrochalcone has been reported in Dracaena cochinchinensis, Soymida febrifuga, and Dracaena draco with data available.

CAS Number15097-74-2
PubChem CID10801179
IUPAC Name3-(2,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)propan-1-one
Molecular FormulaC15H14O4
Molecular Weight258.27
XLogP2.4
Topological Polar Surface Area77.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count19
Formal Charge0
Complexity297
SMILES
C1=CC(=CC=C1C(=O)CCC2=C(C=C(C=C2)O)O)O
InChI
InChI=1S/C15H14O4/c16-12-5-1-10(2-6-12)14(18)8-4-11-3-7-13(17)9-15(11)19/h1-3,5-7,9,16-17,19H,4,8H2
InChIKey
IVBQZFJZIGYXMK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,4,4'-Trihydroxydihydrochalcone
CAS: 15097-74-2
CID: 10801179
Formula: C15H14O4
MW: 258.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight258.27
XLogP32.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass258.08920892
Monoisotopic Mass258.08920892
Topological Polar Surface Area77.8 Ų
Heavy Atom Count19
Formal Charge0
Complexity297
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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