2-ethyl-6-(4-ethylphenyl)phenol

C16H18O — CID 101302359

IUPAC2-ethyl-6-(4-ethylphenyl)phenol
SMILESCCc1ccc(-c2cccc(CC)c2O)cc1
InChIInChI=1S/C16H18O/c1-3-12-8-10-14(11-9-12)15-7-5-6-13(4-2)16(15)17/h5-11,17H,3-4H2,1-2H3
InChIKeyYJBUWHXIGRCQOG-UHFFFAOYSA-N
MW226.32 g/mol
LogP4.18
Rot. Bonds3

About 2-ethyl-6-(4-ethylphenyl)phenol

2-ethyl-6-(4-ethylphenyl)phenol (PubChem CID 101302359) has the molecular formula C16H18O and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-ethyl-6-(4-ethylphenyl)phenol.

Molecular Properties

Compound Name2-ethyl-6-(4-ethylphenyl)phenol
PubChem CID101302359
Molecular FormulaC16H18O
Molecular Weight226.32 g/mol
Exact Mass226.14
IUPAC Name2-ethyl-6-(4-ethylphenyl)phenol
SMILESCCc1ccc(-c2cccc(CC)c2O)cc1
InChIInChI=1S/C16H18O/c1-3-12-8-10-14(11-9-12)15-7-5-6-13(4-2)16(15)17/h5-11,17H,3-4H2,1-2H3
InChIKeyYJBUWHXIGRCQOG-UHFFFAOYSA-N
XLogP4.18
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-(4-ethylphenyl)phenol?
The IUPAC name of 2-ethyl-6-(4-ethylphenyl)phenol (CID 101302359) is 2-ethyl-6-(4-ethylphenyl)phenol.
What is the SMILES notation for 2-ethyl-6-(4-ethylphenyl)phenol?
The canonical SMILES for 2-ethyl-6-(4-ethylphenyl)phenol is CCc1ccc(-c2cccc(CC)c2O)cc1.
What is the InChIKey of 2-ethyl-6-(4-ethylphenyl)phenol?
The InChIKey is YJBUWHXIGRCQOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O/c1-3-12-8-10-14(11-9-12)15-7-5-6-13(4-2)16(15)17/h5-11,17H,3-4H2,1-2H3.
What are the key properties of 2-ethyl-6-(4-ethylphenyl)phenol?
2-ethyl-6-(4-ethylphenyl)phenol has a molecular weight of 226.32 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-(4-ethylphenyl)phenol is sourced from PubChem (CID 101302359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).