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(E)-4-(2,6-Dimethoxystyryl)-3-methoxyphenol

CAT: 0572-TRC-D479450-25MGSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D479450-25MGSize:25 mg
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CAS Number
1798394-84-9
Synonyms
trans-2,2’,6’-Trimethoxy-4-hydroxystilbene; (E)-2,2’,6’-Trimethoxy-4-hydroxystilbene
Hazard Statement
No Data Available
Smiles
OC1=CC(OC)=C(C=C1)/C=C/C2=C(C=CC=C2OC)OC
Molecular Formula
C17H18O4
Molecular Weight
286.3
InChI
InChI=1S/C17H18O4/c1-19-15-5-4-6-16(20-2)14(15)10-8-12-7-9-13(18)11-17(12)21-3/h4-11,18H,1-3H3/b10-8+
Additionnal Information
IUPAC name: (E)-4-(2,6-dimethoxystyryl)-3-methoxyphenol
Shipping Conditions
Room Temperature

Chemical Information

(E)-4-(2,6-dimethoxystyryl)-3-methoxyphenol
CAS Number1798394-84-9
PubChem CID124518658
IUPAC Name4-[(E)-2-(2,6-dimethoxyphenyl)ethenyl]-3-methoxyphenol
Molecular FormulaC17H18O4
Molecular Weight286.32
XLogP3.8
Topological Polar Surface Area47.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count21
Formal Charge0
Complexity319
SMILES
COC1=C(C(=CC=C1)OC)/C=C/C2=C(C=C(C=C2)O)OC
InChI
InChI=1S/C17H18O4/c1-19-15-5-4-6-16(20-2)14(15)10-8-12-7-9-13(18)11-17(12)21-3/h4-11,18H,1-3H3/b10-8+
InChIKey
QTKLRRLBFLUBQP-CSKARUKUSA-N
Chemical Structure
2D Structure
2D structure of (E)-4-(2,6-dimethoxystyryl)-3-methoxyphenol
CAS: 1798394-84-9
CID: 124518658
Formula: C17H18O4
MW: 286.32
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight286.32
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass286.12050905
Monoisotopic Mass286.12050905
Topological Polar Surface Area47.9 Ų
Heavy Atom Count21
Formal Charge0
Complexity319
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