4-(4-ethylphenyl)-3-methylphenol

C15H16O — CID 83130010

IUPAC4-(4-ethylphenyl)-3-methylphenol
SMILESCCc1ccc(-c2ccc(O)cc2C)cc1
InChIInChI=1S/C15H16O/c1-3-12-4-6-13(7-5-12)15-9-8-14(16)10-11(15)2/h4-10,16H,3H2,1-2H3
InChIKeyLMZJUDGMKNNXOG-UHFFFAOYSA-N
MW212.29 g/mol
LogP3.93
Rot. Bonds2

About 4-(4-ethylphenyl)-3-methylphenol

4-(4-ethylphenyl)-3-methylphenol (PubChem CID 83130010) has the molecular formula C15H16O and a molecular weight of 212.29 g/mol. Its IUPAC name is 4-(4-ethylphenyl)-3-methylphenol.

Molecular Properties

Compound Name4-(4-ethylphenyl)-3-methylphenol
PubChem CID83130010
Molecular FormulaC15H16O
Molecular Weight212.29 g/mol
Exact Mass212.12
IUPAC Name4-(4-ethylphenyl)-3-methylphenol
SMILESCCc1ccc(-c2ccc(O)cc2C)cc1
InChIInChI=1S/C15H16O/c1-3-12-4-6-13(7-5-12)15-9-8-14(16)10-11(15)2/h4-10,16H,3H2,1-2H3
InChIKeyLMZJUDGMKNNXOG-UHFFFAOYSA-N
XLogP3.93
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(4-ethylphenyl)-3-methylphenol?
The IUPAC name of 4-(4-ethylphenyl)-3-methylphenol (CID 83130010) is 4-(4-ethylphenyl)-3-methylphenol.
What is the SMILES notation for 4-(4-ethylphenyl)-3-methylphenol?
The canonical SMILES for 4-(4-ethylphenyl)-3-methylphenol is CCc1ccc(-c2ccc(O)cc2C)cc1.
What is the InChIKey of 4-(4-ethylphenyl)-3-methylphenol?
The InChIKey is LMZJUDGMKNNXOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O/c1-3-12-4-6-13(7-5-12)15-9-8-14(16)10-11(15)2/h4-10,16H,3H2,1-2H3.
What are the key properties of 4-(4-ethylphenyl)-3-methylphenol?
4-(4-ethylphenyl)-3-methylphenol has a molecular weight of 212.29 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethylphenyl)-3-methylphenol is sourced from PubChem (CID 83130010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).