2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol

C15H16O2 — CID 101299239

IUPAC2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol
SMILESCc1ccc(-c2c(O)ccc(C)c2C)c(O)c1
InChIInChI=1S/C15H16O2/c1-9-4-6-12(14(17)8-9)15-11(3)10(2)5-7-13(15)16/h4-8,16-17H,1-3H3
InChIKeyWUJBWLWVLDQNSH-UHFFFAOYSA-N
MW228.29 g/mol
LogP3.69
Rot. Bonds1

About 2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol

2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol (PubChem CID 101299239) has the molecular formula C15H16O2 and a molecular weight of 228.29 g/mol. Its IUPAC name is 2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol.

Molecular Properties

Compound Name2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol
PubChem CID101299239
Molecular FormulaC15H16O2
Molecular Weight228.29 g/mol
Exact Mass228.12
IUPAC Name2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol
SMILESCc1ccc(-c2c(O)ccc(C)c2C)c(O)c1
InChIInChI=1S/C15H16O2/c1-9-4-6-12(14(17)8-9)15-11(3)10(2)5-7-13(15)16/h4-8,16-17H,1-3H3
InChIKeyWUJBWLWVLDQNSH-UHFFFAOYSA-N
XLogP3.69
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dimethylphenol;ethane
CID 143419778
bis(2,5-dimethylphenol);dihydrochloride
CID 70596946
2,5-dimethylphenol;samarium
CID 87732062
2-(2,3,6-trimethylphenyl)benzene-1,4-diol
CID 101299187
bis(4-methylbenzene-1,2-diol);zirconium
CID 23558294
2,4-dimethylphenol
CID 67713801
2,3-dimethylphenol;2,5-dimethylphenol;zirconium;hydrochloride
CID 173197082
2,4-dimethylphenol;yttrium
CID 87733318
CID 175892141
CID 175892141
CID 172763014
CID 172763014
2,5-dimethylphenol;4-methylphenol
CID 67649093
3,8-dimethylazulen-4-ol
CID 11557365

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol?
The IUPAC name of 2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol (CID 101299239) is 2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol.
What is the SMILES notation for 2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol?
The canonical SMILES for 2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol is Cc1ccc(-c2c(O)ccc(C)c2C)c(O)c1.
What is the InChIKey of 2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol?
The InChIKey is WUJBWLWVLDQNSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2/c1-9-4-6-12(14(17)8-9)15-11(3)10(2)5-7-13(15)16/h4-8,16-17H,1-3H3.
What are the key properties of 2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol?
2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol has a molecular weight of 228.29 g/mol, XLogP of 3.69, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-4-methylphenyl)-3,4-dimethylphenol is sourced from PubChem (CID 101299239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).