2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol

C19H22O6 — CID 69302242

IUPAC2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol
SMILESCOc1cc(C=Cc2cc(OC)c(OC)c(OC)c2)cc(O)c1OC
InChIInChI=1S/C19H22O6/c1-21-15-9-12(8-14(20)18(15)24-4)6-7-13-10-16(22-2)19(25-5)17(11-13)23-3/h6-11,20H,1-5H3
InChIKeyAOKFYXSBWTUOGD-UHFFFAOYSA-N
MW346.38 g/mol
LogP3.61
Rot. Bonds7

About 2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol

2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol (PubChem CID 69302242) has the molecular formula C19H22O6 and a molecular weight of 346.38 g/mol. Its IUPAC name is 2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol.

Molecular Properties

Compound Name2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol
PubChem CID69302242
Molecular FormulaC19H22O6
Molecular Weight346.38 g/mol
Exact Mass346.14
IUPAC Name2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol
SMILESCOc1cc(C=Cc2cc(OC)c(OC)c(OC)c2)cc(O)c1OC
InChIInChI=1S/C19H22O6/c1-21-15-9-12(8-14(20)18(15)24-4)6-7-13-10-16(22-2)19(25-5)17(11-13)23-3/h6-11,20H,1-5H3
InChIKeyAOKFYXSBWTUOGD-UHFFFAOYSA-N
XLogP3.61
TPSA66.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.38
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

5-[(Z)-2-(3,4-dimethoxyphenyl)ethenyl]-2,3-dimethoxyphenol
CID 5386528
5-[(E)-3-hydroxyprop-1-enyl]-2,3-dimethoxyphenol
CID 14830746
[5-[(Z)-2-(3-hydroxy-4,5-dimethoxyphenyl)ethenyl]-2-methoxyphenyl]azanium chloride
CID 44584265
2-ethyl-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol
CID 139943086
acetic acid;6-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1-benzofuran-4-ol
CID 71416233
2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol
CID 142237968
3-[2-(3,4,5-trimethoxyphenyl)ethenyl]benzene-1,2-diol
CID 69301541
4-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-2,6-dimethoxyphenol
CID 71361751
5-[2-(3,4-dimethoxyphenyl)ethenyl]-1,2,3-trimethoxybenzene;phosphoric acid
CID 69301542
2,3-dimethoxy-5-[(Z)-2-(1-methylindol-5-yl)ethenyl]phenol;yttrium
CID 177336882
5-[(Z)-2-(3-fluorosulfonyloxy-4-methoxyphenyl)ethenyl]-1,2,3-trimethoxybenzene;2-methoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol
CID 163428609
1,2,3-trimethoxy-5-[2-(2,4,5-trimethoxyphenyl)ethenyl]benzene
CID 85446251

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol?
The IUPAC name of 2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol (CID 69302242) is 2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol.
What is the SMILES notation for 2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol?
The canonical SMILES for 2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol is COc1cc(C=Cc2cc(OC)c(OC)c(OC)c2)cc(O)c1OC.
What is the InChIKey of 2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol?
The InChIKey is AOKFYXSBWTUOGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O6/c1-21-15-9-12(8-14(20)18(15)24-4)6-7-13-10-16(22-2)19(25-5)17(11-13)23-3/h6-11,20H,1-5H3.
What are the key properties of 2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol?
2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol has a molecular weight of 346.38 g/mol, XLogP of 3.61, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenol is sourced from PubChem (CID 69302242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).