2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol

C16H18O5 — CID 165177874

IUPAC2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol
SMILESCOc1ccc(-c2c(O)cc(OC)cc2OC)c(OC)c1
InChIInChI=1S/C16H18O5/c1-18-10-5-6-12(14(8-10)20-3)16-13(17)7-11(19-2)9-15(16)21-4/h5-9,17H,1-4H3
InChIKeyCFBOOFBKJGPIQL-UHFFFAOYSA-N
MW290.32 g/mol
LogP3.09
Rot. Bonds5

About 2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol

2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol (PubChem CID 165177874) has the molecular formula C16H18O5 and a molecular weight of 290.32 g/mol. Its IUPAC name is 2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol.

Molecular Properties

Compound Name2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol
PubChem CID165177874
Molecular FormulaC16H18O5
Molecular Weight290.32 g/mol
Exact Mass290.12
IUPAC Name2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol
SMILESCOc1ccc(-c2c(O)cc(OC)cc2OC)c(OC)c1
InChIInChI=1S/C16H18O5/c1-18-10-5-6-12(14(8-10)20-3)16-13(17)7-11(19-2)9-15(16)21-4/h5-9,17H,1-4H3
InChIKeyCFBOOFBKJGPIQL-UHFFFAOYSA-N
XLogP3.09
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-2-(2,4-dimethoxyphenyl)phenol;hydrochloride
CID 22173838
2-[4,6-bis(2-hydroxy-4,6-dimethoxyphenyl)-1,3,5-triazin-2-yl]-3,5-dimethoxyphenol
CID 136758978
3,5-ditert-butyl-2,6-bis(2,4-dimethoxyphenyl)phenol
CID 10435212
4-(2,4-dimethoxyphenyl)-3-fluorophenol
CID 53219547
5-methoxy-2-(4-methoxyphenyl)phenol
CID 10933283
1-[2-(2,4-dimethoxyphenyl)phenyl]-2,4-dimethoxybenzene
CID 70200625
2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol
CID 116889764
4-(2,4-dimethoxyphenyl)-3-ethoxyphenol
CID 54469913
8-hydroxy-1,3-dimethoxyanthracene-9,10-dione
CID 158328422
2-(1,3-benzothiazol-2-yl)-3,5-dimethoxyphenol
CID 136746012
2-[3-(2-hydroxy-4-methoxyphenyl)-5-(4-methoxyphenyl)phenyl]-5-methoxyphenol
CID 20730822
1-(2,4-dimethoxyphenyl)-2-(2-hydroxy-4-methoxyphenyl)ethane-1,2-dione
CID 14018354

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol?
The IUPAC name of 2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol (CID 165177874) is 2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol.
What is the SMILES notation for 2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol?
The canonical SMILES for 2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol is COc1ccc(-c2c(O)cc(OC)cc2OC)c(OC)c1.
What is the InChIKey of 2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol?
The InChIKey is CFBOOFBKJGPIQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O5/c1-18-10-5-6-12(14(8-10)20-3)16-13(17)7-11(19-2)9-15(16)21-4/h5-9,17H,1-4H3.
What are the key properties of 2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol?
2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol has a molecular weight of 290.32 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol is sourced from PubChem (CID 165177874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).