4-ethoxy-2,6-diethyl-3-methylphenol

C13H20O2 — CID 162375052

IUPAC4-ethoxy-2,6-diethyl-3-methylphenol
SMILESCCOc1cc(CC)c(O)c(CC)c1C
InChIInChI=1S/C13H20O2/c1-5-10-8-12(15-7-3)9(4)11(6-2)13(10)14/h8,14H,5-7H2,1-4H3
InChIKeyPOZQAAAFXUDBJV-UHFFFAOYSA-N
MW208.30 g/mol
LogP3.22
Rot. Bonds4

About 4-ethoxy-2,6-diethyl-3-methylphenol

4-ethoxy-2,6-diethyl-3-methylphenol (PubChem CID 162375052) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is 4-ethoxy-2,6-diethyl-3-methylphenol.

Molecular Properties

Compound Name4-ethoxy-2,6-diethyl-3-methylphenol
PubChem CID162375052
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name4-ethoxy-2,6-diethyl-3-methylphenol
SMILESCCOc1cc(CC)c(O)c(CC)c1C
InChIInChI=1S/C13H20O2/c1-5-10-8-12(15-7-3)9(4)11(6-2)13(10)14/h8,14H,5-7H2,1-4H3
InChIKeyPOZQAAAFXUDBJV-UHFFFAOYSA-N
XLogP3.22
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethoxy-2-ethyl-3-methylphenol
CID 162375114
4-ethoxy-5-ethyl-2,3-dimethylphenol
CID 162375138
5-ethoxy-4-methylbenzene-1,3-diol
CID 130032613
3-ethoxy-4,5-diethylbenzene-1,2-diol
CID 154435107
1-ethoxy-4-ethyl-2,5-dimethylbenzene
CID 84761080
5-ethyl-2-methyl-3-propylbenzene-1,4-diol
CID 139946402
3,5-diethyl-2,6-dimethylphenol
CID 23451688
5-ethyl-2,3-dimethylbenzene-1,4-diol
CID 86605484
2-(2,5-diethoxy-4-methylphenyl)acetic acid
CID 4286018
6-ethoxy-2,3-dimethylphenol
CID 119015224
2-ethyl-6-methoxy-4-methylphenol
CID 23597037
1-bromo-4-ethoxy-2,5-diethylbenzene
CID 146408869

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-2,6-diethyl-3-methylphenol?
The IUPAC name of 4-ethoxy-2,6-diethyl-3-methylphenol (CID 162375052) is 4-ethoxy-2,6-diethyl-3-methylphenol.
What is the SMILES notation for 4-ethoxy-2,6-diethyl-3-methylphenol?
The canonical SMILES for 4-ethoxy-2,6-diethyl-3-methylphenol is CCOc1cc(CC)c(O)c(CC)c1C.
What is the InChIKey of 4-ethoxy-2,6-diethyl-3-methylphenol?
The InChIKey is POZQAAAFXUDBJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2/c1-5-10-8-12(15-7-3)9(4)11(6-2)13(10)14/h8,14H,5-7H2,1-4H3.
What are the key properties of 4-ethoxy-2,6-diethyl-3-methylphenol?
4-ethoxy-2,6-diethyl-3-methylphenol has a molecular weight of 208.30 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-2,6-diethyl-3-methylphenol is sourced from PubChem (CID 162375052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).