2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol

C18H22O2 — CID 151768924

IUPAC2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol
SMILESCc1cc(C)c(C)c(-c2c(C)c(C)c(O)c(C)c2O)c1
InChIInChI=1S/C18H22O2/c1-9-7-10(2)11(3)15(8-9)16-12(4)13(5)17(19)14(6)18(16)20/h7-8,19-20H,1-6H3
InChIKeyRSEKJPPYLBJINE-UHFFFAOYSA-N
MW270.37 g/mol
LogP4.62
Rot. Bonds1

About 2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol

2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol (PubChem CID 151768924) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol.

Molecular Properties

Compound Name2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol
PubChem CID151768924
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Name2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol
SMILESCc1cc(C)c(C)c(-c2c(C)c(C)c(O)c(C)c2O)c1
InChIInChI=1S/C18H22O2/c1-9-7-10(2)11(3)15(8-9)16-12(4)13(5)17(19)14(6)18(16)20/h7-8,19-20H,1-6H3
InChIKeyRSEKJPPYLBJINE-UHFFFAOYSA-N
XLogP4.62
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol?
The IUPAC name of 2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol (CID 151768924) is 2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol.
What is the SMILES notation for 2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol?
The canonical SMILES for 2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol is Cc1cc(C)c(C)c(-c2c(C)c(C)c(O)c(C)c2O)c1.
What is the InChIKey of 2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol?
The InChIKey is RSEKJPPYLBJINE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2/c1-9-7-10(2)11(3)15(8-9)16-12(4)13(5)17(19)14(6)18(16)20/h7-8,19-20H,1-6H3.
What are the key properties of 2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol?
2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol has a molecular weight of 270.37 g/mol, XLogP of 4.62, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-6-(2,3,5-trimethylphenyl)benzene-1,3-diol is sourced from PubChem (CID 151768924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).