2-Hydroxy-3,4,5,6-tetramethoxychalcone

CAT: 0926-UIA29874-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0926-UIA29874-01Size:5 mg

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CAS Number

219298-74-5

MDL Number

MFCD23103660

Smiles

COC1=C (C (=C (C (=C1C=CC (=O) C2=CC=CC=C2) O) OC) OC) OC

Molecular Formula

C19H20O6

Molecular Weight

344.4 g/mol

Controlled

Chemical Information

2-Hydroxy-3,4,5,6-tetramethoxychalcone

CAS Number	219298-74-5
PubChem CID	73554054
IUPAC Name	(E)-3-(2-hydroxy-3,4,5,6-tetramethoxyphenyl)-1-phenylprop-2-en-1-one
Molecular Formula	C19H20O6
Molecular Weight	344.4
XLogP	3.2
Topological Polar Surface Area	74.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	7
Heavy Atom Count	25
Formal Charge	0
Complexity	445

SMILES

COC1=C(C(=C(C(=C1/C=C/C(=O)C2=CC=CC=C2)O)OC)OC)OC

InChI

InChI=1S/C19H20O6/c1-22-16-13(10-11-14(20)12-8-6-5-7-9-12)15(21)17(23-2)19(25-4)18(16)24-3/h5-11,21H,1-4H3/b11-10+

InChIKey

WKHFCYYMOLJMDZ-ZHACJKMWSA-N

Chemical Structure

2D Structure

CAS: 219298-74-5

CID: 73554054

Formula: C19H20O6

MW: 344.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	344.4
XLogP3	3.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	7
Exact Mass	344.12598835
Monoisotopic Mass	344.12598835
Topological Polar Surface Area	74.2 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	445
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FH65426-01	2'-Hydroxy-2,5,4',6'-tetramethoxychalcone
FH66395-01	2'-Hydroxy-3,4,4',6'-tetramethoxychalcone
FH66394-01	2'-Hydroxy-2,4,4',6'-tetramethoxychalcone
FH67446-01	3-Hydroxy-7,2',4',5'-tetramethoxychalcone
ABA16367-01	2',4,4',6'-Tetramethoxychalcone
RDA59159-01	2-Hydroxy-4,5,6-trimethylnicotinonitrile
YCA69415-01	2'-Hydroxy-2,4,4',5,6'-pentamethoxychalcone
XH183013-01	3-Hydroxy-6,2',4',5'-tetramethoxyflavone
ND69830-01	2,4-Diamino-6-hydroxy-5-nitrosopyrimidine
FD21462-01	2,4-Diamino-6-hydroxy-5-nitropyrimidine

Catalog	Name
378897	2-Hydroxy-3,4,5,6-tetramethoxychalcone
GTR19266473-01	2'-Hydroxy-3,4,4',6'-Tetramethoxychalcone
GTR19270179	2'-Hydroxy-4,3',4',6'-tetramethoxychalcone
HY-N12549-01	4,2′,4′,6′-Tetramethoxychalcone
MBS5789015	2',4,4',6'-Tetramethoxychalcone
sc-470911	4-Hydroxy-2,2',3,4',5,5',6-heptachlorobiphenyl
GTR19279177-01	2'-hydroxy-3,4,4',5',6'-pentamethoxychalcone
sc-299061A	3-Hydroxy-2',4',5',6-tetramethoxyflavone
PC9677-01	4-Hydroxy-2,3,5,6-tetrafluoropyridine
PC450235	4-Hydroxy-2,3,5,6-tetrafluorostyrene