4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol

C16H18O2 — CID 139788678

IUPAC4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol
SMILESCc1cc(-c2ccc(O)c(C)c2C)cc(C)c1O
InChIInChI=1S/C16H18O2/c1-9-7-13(8-10(2)16(9)18)14-5-6-15(17)12(4)11(14)3/h5-8,17-18H,1-4H3
InChIKeyUVHQASPKHACEAP-UHFFFAOYSA-N
MW242.32 g/mol
LogP4.00
Rot. Bonds1

About 4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol

4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol (PubChem CID 139788678) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol.

Molecular Properties

Compound Name4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol
PubChem CID139788678
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol
SMILESCc1cc(-c2ccc(O)c(C)c2C)cc(C)c1O
InChIInChI=1S/C16H18O2/c1-9-7-13(8-10(2)16(9)18)14-5-6-15(17)12(4)11(14)3/h5-8,17-18H,1-4H3
InChIKeyUVHQASPKHACEAP-UHFFFAOYSA-N
XLogP4.00
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-bis(4-hydroxy-3,5-dimethylphenyl)benzene-1,2-diol
CID 151204371
4-(3,4,5-trimethylphenyl)benzene-1,2,3-triol
CID 101299553
2,3-dimethyl-4-phenylphenol
CID 57091246
3-(4-hydroxy-3,5-dimethylphenyl)benzene-1,2-diol
CID 101299392
ethane;4-(4-hydroxy-3,5-dimethylphenyl)benzene-1,2-diol
CID 174407562
2,3-dimethylbenzene-1,4-diol;hydrate
CID 172699169
5-(4-hydroxy-3,5-dimethylphenyl)-3-methylbenzene-1,2-diol
CID 130228173
2,3,5-trimethylbenzene-1,4-diol
CID 87406815
5-(3,4-dihydroxy-5-methylphenyl)-3-methylbenzene-1,2-diol
CID 142760792
4-[3-(4-hydroxy-3,5-dimethylphenyl)phenyl]-2,6-dimethylphenol
CID 21020641
actinium;2,3,5-trimethylbenzene-1,4-diol
CID 22949987
2,6-bis(4-hydroxy-3-methylphenyl)-4-methylphenol
CID 150395203

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol?
The IUPAC name of 4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol (CID 139788678) is 4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol.
What is the SMILES notation for 4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol?
The canonical SMILES for 4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol is Cc1cc(-c2ccc(O)c(C)c2C)cc(C)c1O.
What is the InChIKey of 4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol?
The InChIKey is UVHQASPKHACEAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c1-9-7-13(8-10(2)16(9)18)14-5-6-15(17)12(4)11(14)3/h5-8,17-18H,1-4H3.
What are the key properties of 4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol?
4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol has a molecular weight of 242.32 g/mol, XLogP of 4.00, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxy-3,5-dimethylphenyl)-2,3-dimethylphenol is sourced from PubChem (CID 139788678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).