4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol

C17H20O5 — CID 91244154

IUPAC4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol
SMILESCOc1ccc(Cc2cc(OC)c(O)c(OC)c2)c(OC)c1
InChIInChI=1S/C17H20O5/c1-19-13-6-5-12(14(10-13)20-2)7-11-8-15(21-3)17(18)16(9-11)22-4/h5-6,8-10,18H,7H2,1-4H3
InChIKeyIMNNFEXGOYMMJR-UHFFFAOYSA-N
MW304.34 g/mol
LogP3.02
Rot. Bonds6

About 4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol

4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol (PubChem CID 91244154) has the molecular formula C17H20O5 and a molecular weight of 304.34 g/mol. Its IUPAC name is 4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol.

Molecular Properties

Compound Name4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol
PubChem CID91244154
Molecular FormulaC17H20O5
Molecular Weight304.34 g/mol
Exact Mass304.13
IUPAC Name4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol
SMILESCOc1ccc(Cc2cc(OC)c(O)c(OC)c2)c(OC)c1
InChIInChI=1S/C17H20O5/c1-19-13-6-5-12(14(10-13)20-2)7-11-8-15(21-3)17(18)16(9-11)22-4/h5-6,8-10,18H,7H2,1-4H3
InChIKeyIMNNFEXGOYMMJR-UHFFFAOYSA-N
XLogP3.02
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.34
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-dimethoxy-1-[(3-methoxyphenyl)methyl]benzene
CID 173405518
1-(iodomethyl)-2,4-dimethoxybenzene
CID 91883521
1-(2,2-dimethylpropyl)-2,4-dimethoxybenzene;methane
CID 158953080
1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-dimethoxybenzene
CID 54567492
(2R)-1-(2,4-dimethoxyphenyl)propan-2-ol
CID 75406786
(NE)-N-[1-(2,4-dimethoxyphenyl)propan-2-ylidene]hydroxylamine
CID 24721588
bis[(2,4-dimethoxyphenyl)methyl] hydrogen phosphite
CID 69443369
2-[[(2,4-dimethoxyphenyl)methylamino]methyl]phenol
CID 62732592
1-(2-bromo-2-methylpropyl)-2,4-dimethoxybenzene
CID 82255129
4-methoxy-2-[(4-methoxyphenyl)methyl]phenol
CID 67461298
2,4-dimethoxy-1-[3-[4-methoxy-2-[(4-methoxyphenyl)methoxy]phenyl]propyl]benzene
CID 139826649
2-[(2,4-dimethoxyphenyl)methyl]-2-methylpropane-1,3-diol
CID 94687748

Frequently Asked Questions

What is the IUPAC name of 4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol?
The IUPAC name of 4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol (CID 91244154) is 4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol.
What is the SMILES notation for 4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol?
The canonical SMILES for 4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol is COc1ccc(Cc2cc(OC)c(O)c(OC)c2)c(OC)c1.
What is the InChIKey of 4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol?
The InChIKey is IMNNFEXGOYMMJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O5/c1-19-13-6-5-12(14(10-13)20-2)7-11-8-15(21-3)17(18)16(9-11)22-4/h5-6,8-10,18H,7H2,1-4H3.
What are the key properties of 4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol?
4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol has a molecular weight of 304.34 g/mol, XLogP of 3.02, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,4-dimethoxyphenyl)methyl]-2,6-dimethoxyphenol is sourced from PubChem (CID 91244154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).