2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol

C16H18O5 — CID 44715357

IUPAC2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol
SMILESCOc1cc(C)c(Oc2cc(C)cc(OC)c2O)c(O)c1
InChIInChI=1S/C16H18O5/c1-9-5-13(20-4)15(18)14(6-9)21-16-10(2)7-11(19-3)8-12(16)17/h5-8,17-18H,1-4H3
InChIKeyWIOKWEJDRXNVSH-UHFFFAOYSA-N
MW290.32 g/mol
LogP3.52
Rot. Bonds4

About 2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol

2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol (PubChem CID 44715357) has the molecular formula C16H18O5 and a molecular weight of 290.32 g/mol. Its IUPAC name is 2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol.

Molecular Properties

Compound Name2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol
PubChem CID44715357
Molecular FormulaC16H18O5
Molecular Weight290.32 g/mol
Exact Mass290.12
IUPAC Name2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol
SMILESCOc1cc(C)c(Oc2cc(C)cc(OC)c2O)c(O)c1
InChIInChI=1S/C16H18O5/c1-9-5-13(20-4)15(18)14(6-9)21-16-10(2)7-11(19-3)8-12(16)17/h5-8,17-18H,1-4H3
InChIKeyWIOKWEJDRXNVSH-UHFFFAOYSA-N
XLogP3.52
TPSA68.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol?
The IUPAC name of 2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol (CID 44715357) is 2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol.
What is the SMILES notation for 2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol?
The canonical SMILES for 2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol is COc1cc(C)c(Oc2cc(C)cc(OC)c2O)c(O)c1.
What is the InChIKey of 2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol?
The InChIKey is WIOKWEJDRXNVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O5/c1-9-5-13(20-4)15(18)14(6-9)21-16-10(2)7-11(19-3)8-12(16)17/h5-8,17-18H,1-4H3.
What are the key properties of 2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol?
2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol has a molecular weight of 290.32 g/mol, XLogP of 3.52, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-4-methoxy-6-methylphenoxy)-6-methoxy-4-methylphenol is sourced from PubChem (CID 44715357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).