2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol

C17H20O — CID 90291954

IUPAC2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol
SMILESCc1cc(C)c(C)c(-c2cc(C)cc(C)c2O)c1
InChIInChI=1S/C17H20O/c1-10-6-12(3)14(5)15(8-10)16-9-11(2)7-13(4)17(16)18/h6-9,18H,1-5H3
InChIKeyHFKMWJRLAMPFCT-UHFFFAOYSA-N
MW240.35 g/mol
LogP4.60
Rot. Bonds1

About 2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol

2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol (PubChem CID 90291954) has the molecular formula C17H20O and a molecular weight of 240.35 g/mol. Its IUPAC name is 2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol.

Molecular Properties

Compound Name2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol
PubChem CID90291954
Molecular FormulaC17H20O
Molecular Weight240.35 g/mol
Exact Mass240.15
IUPAC Name2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol
SMILESCc1cc(C)c(C)c(-c2cc(C)cc(C)c2O)c1
InChIInChI=1S/C17H20O/c1-10-6-12(3)14(5)15(8-10)16-9-11(2)7-13(4)17(16)18/h6-9,18H,1-5H3
InChIKeyHFKMWJRLAMPFCT-UHFFFAOYSA-N
XLogP4.60
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol?
The IUPAC name of 2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol (CID 90291954) is 2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol.
What is the SMILES notation for 2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol?
The canonical SMILES for 2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol is Cc1cc(C)c(C)c(-c2cc(C)cc(C)c2O)c1.
What is the InChIKey of 2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol?
The InChIKey is HFKMWJRLAMPFCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O/c1-10-6-12(3)14(5)15(8-10)16-9-11(2)7-13(4)17(16)18/h6-9,18H,1-5H3.
What are the key properties of 2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol?
2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol has a molecular weight of 240.35 g/mol, XLogP of 4.60, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-(2,3,5-trimethylphenyl)phenol is sourced from PubChem (CID 90291954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).