4-cyclohexyl-5-ethoxy-2-methylphenol

C15H22O2 — CID 59929209

IUPAC4-cyclohexyl-5-ethoxy-2-methylphenol
SMILESCCOc1cc(O)c(C)cc1C1CCCCC1
InChIInChI=1S/C15H22O2/c1-3-17-15-10-14(16)11(2)9-13(15)12-7-5-4-6-8-12/h9-10,12,16H,3-8H2,1-2H3
InChIKeyQHJJPBRXOLGCJB-UHFFFAOYSA-N
MW234.34 g/mol
LogP4.15
Rot. Bonds3

About 4-cyclohexyl-5-ethoxy-2-methylphenol

4-cyclohexyl-5-ethoxy-2-methylphenol (PubChem CID 59929209) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is 4-cyclohexyl-5-ethoxy-2-methylphenol.

Molecular Properties

Compound Name4-cyclohexyl-5-ethoxy-2-methylphenol
PubChem CID59929209
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name4-cyclohexyl-5-ethoxy-2-methylphenol
SMILESCCOc1cc(O)c(C)cc1C1CCCCC1
InChIInChI=1S/C15H22O2/c1-3-17-15-10-14(16)11(2)9-13(15)12-7-5-4-6-8-12/h9-10,12,16H,3-8H2,1-2H3
InChIKeyQHJJPBRXOLGCJB-UHFFFAOYSA-N
XLogP4.15
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-5-ethoxy-2-methylphenol?
The IUPAC name of 4-cyclohexyl-5-ethoxy-2-methylphenol (CID 59929209) is 4-cyclohexyl-5-ethoxy-2-methylphenol.
What is the SMILES notation for 4-cyclohexyl-5-ethoxy-2-methylphenol?
The canonical SMILES for 4-cyclohexyl-5-ethoxy-2-methylphenol is CCOc1cc(O)c(C)cc1C1CCCCC1.
What is the InChIKey of 4-cyclohexyl-5-ethoxy-2-methylphenol?
The InChIKey is QHJJPBRXOLGCJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O2/c1-3-17-15-10-14(16)11(2)9-13(15)12-7-5-4-6-8-12/h9-10,12,16H,3-8H2,1-2H3.
What are the key properties of 4-cyclohexyl-5-ethoxy-2-methylphenol?
4-cyclohexyl-5-ethoxy-2-methylphenol has a molecular weight of 234.34 g/mol, XLogP of 4.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-5-ethoxy-2-methylphenol is sourced from PubChem (CID 59929209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).