3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol

C15H16O2 — CID 101299322

IUPAC3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol
SMILESCc1ccc(-c2cc(O)cc(C)c2C)cc1O
InChIInChI=1S/C15H16O2/c1-9-4-5-12(7-15(9)17)14-8-13(16)6-10(2)11(14)3/h4-8,16-17H,1-3H3
InChIKeyBQFAFQWEZFUVIX-UHFFFAOYSA-N
MW228.29 g/mol
LogP3.69
Rot. Bonds1

About 3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol

3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol (PubChem CID 101299322) has the molecular formula C15H16O2 and a molecular weight of 228.29 g/mol. Its IUPAC name is 3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol.

Molecular Properties

Compound Name3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol
PubChem CID101299322
Molecular FormulaC15H16O2
Molecular Weight228.29 g/mol
Exact Mass228.12
IUPAC Name3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol
SMILESCc1ccc(-c2cc(O)cc(C)c2C)cc1O
InChIInChI=1S/C15H16O2/c1-9-4-5-12(7-15(9)17)14-8-13(16)6-10(2)11(14)3/h4-8,16-17H,1-3H3
InChIKeyBQFAFQWEZFUVIX-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

5-(3-hydroxy-4-methylphenyl)-2-methylphenol
CID 22942672
2-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol
CID 101299255
5-(2-hydroxyphenyl)-2-methylphenol
CID 53218780
2-(3,4-dimethylphenyl)-6-methylbenzene-1,4-diol
CID 101299157
5-(4-hydroxyphenyl)-4-methylbenzene-1,3-diol
CID 101299721
5-(3-fluoro-2-methylphenyl)-2-methylphenol
CID 53218846
4,5-dimethylbenzene-1,3-diol;4-methylbenzene-1,3-diol;5-methylbenzene-1,3-diol;2-methylbenzene-1,3,5-triol
CID 157346246
methane;3,4,5-trimethylphenol
CID 174273113
1-(3,4-dimethylphenyl)-2,3,5-trimethylbenzene
CID 143062787
2-(3,4,5-trimethylphenyl)benzene-1,3,5-triol
CID 101299580
2,5-dimethylphenol;4-methylphenol
CID 67649093
5-(3,4-dichlorophenyl)-2-methylphenol
CID 53219084

Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol?
The IUPAC name of 3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol (CID 101299322) is 3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol.
What is the SMILES notation for 3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol?
The canonical SMILES for 3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol is Cc1ccc(-c2cc(O)cc(C)c2C)cc1O.
What is the InChIKey of 3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol?
The InChIKey is BQFAFQWEZFUVIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2/c1-9-4-5-12(7-15(9)17)14-8-13(16)6-10(2)11(14)3/h4-8,16-17H,1-3H3.
What are the key properties of 3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol?
3-(3-hydroxy-4-methylphenyl)-4,5-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 3-(3-hydroxy-4-methylphenyl)-4,5-dimethylphenol is sourced from PubChem (CID 101299322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).