Di-O-methylhonokiol

CAT: 0127-BUP01692-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP01692-01Size:1 mg

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CAS Number

68592-18-7

Synonyms

Honokiol dimethyl ether

Purity

=98%

Smiles

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

Chemical Information

Di-O-methylhonokiol

CAS Number	68592-18-7
PubChem CID	325144
IUPAC Name	1-methoxy-2-(4-methoxy-3-prop-2-enylphenyl)-4-prop-2-enylbenzene
Molecular Formula	C20H22O2
Molecular Weight	294.4
XLogP	5.6
Topological Polar Surface Area	18.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Heavy Atom Count	22
Formal Charge	0
Complexity	352

SMILES

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

InChI

InChI=1S/C20H22O2/c1-5-7-15-9-11-20(22-4)18(13-15)16-10-12-19(21-3)17(14-16)8-6-2/h5-6,9-14H,1-2,7-8H2,3-4H3

InChIKey

GDCJELDNRAWYTE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 68592-18-7

CID: 325144

Formula: C20H22O2

MW: 294.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	294.4
XLogP3	5.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Exact Mass	294.161979940
Monoisotopic Mass	294.161979940
Topological Polar Surface Area	18.5 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	352
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Catalog	Name
GTR19269538	Di-O-methylhonokiol
462793	4'-O-Methylhonokiol
GTR19236899-01	2-O-Methylhonokiol
M32611-01	4-O-Methylhonokiol
MBS5766500-01	Di-O-methyldemethoxyCurcumin
MBS5791601	Di-O-demethylisoguaiacin
M31117-01	Di-O-methylcrenatin
HY-N2317-01	Di-O-demethylcurcumin
446496-01	Di-o-anisamide
M30932-01	Di-O-methylbergenin