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2',3,4,4',6'-Pentahydroxychalcone

CAT: 0926-FP145714-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0926-FP145714-01Size:1 mg
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CAS Number
14917-41-0
Synonyms
Eriodictyol chalcone
Smiles
C1=CC (=C (C=C1/C=C/C (=O) C2=C (C=C (C=C2O) O) O) O) O
Molecular Formula
C15H12O6
Molecular Weight
288.25 g/mol
Controlled
No

Chemical Information

Eriodictyol chalcone

2',3,4,4',6'-pentahydroxychalcone is a member of the class of chalcones that is chalcone substituted by hydroxy groups at positions 2', 3, 4, 4', and 6'. It is functionally related to a chalcone. It is a conjugate acid of a 2',3,4,4',6'-pentahydroxychalcone(1-).

CAS Number14917-41-0
PubChem CID5461154
IUPAC Name(E)-3-(3,4-dihydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop-2-en-1-one
Molecular FormulaC15H12O6
Molecular Weight288.25
XLogP2.9
Topological Polar Surface Area118
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity384
SMILES
C1=CC(=C(C=C1/C=C/C(=O)C2=C(C=C(C=C2O)O)O)O)O
InChI
InChI=1S/C15H12O6/c16-9-6-13(20)15(14(21)7-9)11(18)4-2-8-1-3-10(17)12(19)5-8/h1-7,16-17,19-21H/b4-2+
InChIKey
CRBYNQCDRNZCNX-DUXPYHPUSA-N
Chemical Structure
2D Structure
2D structure of Eriodictyol chalcone
CAS: 14917-41-0
CID: 5461154
Formula: C15H12O6
MW: 288.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight288.25
XLogP32.9
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass288.06338810
Monoisotopic Mass288.06338810
Topological Polar Surface Area118 Ų
Heavy Atom Count21
Formal Charge0
Complexity384
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
JH2341612',3,4,4',5-Pentahydroxychalcone ; ROBTEIN
419427-012, ​2, ​4, ​4, ​6, ​6-​Hexakis (2, ​2, ​3, ​3, ​4, ​4-​hexafluorobutoxy) ​-​2, ​2, ​4, ​4, ​6, ​6-​hexahydro-1, ​3, ​5, ​2, ​4, ​6-​Triazatriphosphorine​
TRC-H293978-10MG2,2,4,4,6,6-Hexakis(2,2,3,3,4,4-hexafluorobutoxy)-2,2,4,4,6,6-hexahydro-1,3,5,2,4,6-Triazatriphosphorine
OR75211-014,4,4',4',6,6,6',6'-Octamethyl-2,2'-bi (1,3,2-dioxaborinane)
TRC-H998645-1MG2,2',3,3',4,4',6-Heptachlorobiphenyl
419429-012,2,4,4,6,6-Hexakis[ (2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl) oxy]-2,2,4,4,6,6-hexahydro- 1,3,5,2,4,6-triazatriphosphorine
RG-E140963-014,4',4''- (2,4,6-trimethyl-1,3,5,2,4,6-trioxatrisilinane-2,4,6-triyl) tributanenitrile
T8968442,3',5-Trichlorobiphenyl-2',3,4,4',6,6'-d6
AR-B07352-012,2',3,3',4,4', 5,5',6,6'-Decachlorobiphenyl
HY-151078S2,3′,5-Trichlorobiphenyl-2′,3,4,4′,6,6′-d6

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