4-ethyl-2,6-dipropylphenol

C14H22O — CID 66879596

IUPAC4-ethyl-2,6-dipropylphenol
SMILESCCCc1cc(CC)cc(CCC)c1O
InChIInChI=1S/C14H22O/c1-4-7-12-9-11(6-3)10-13(8-5-2)14(12)15/h9-10,15H,4-8H2,1-3H3
InChIKeyZCPIQEPQEVUZPZ-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.86
Rot. Bonds5

About 4-ethyl-2,6-dipropylphenol

4-ethyl-2,6-dipropylphenol (PubChem CID 66879596) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is 4-ethyl-2,6-dipropylphenol.

Molecular Properties

Compound Name4-ethyl-2,6-dipropylphenol
PubChem CID66879596
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Name4-ethyl-2,6-dipropylphenol
SMILESCCCc1cc(CC)cc(CCC)c1O
InChIInChI=1S/C14H22O/c1-4-7-12-9-11(6-3)10-13(8-5-2)14(12)15/h9-10,15H,4-8H2,1-3H3
InChIKeyZCPIQEPQEVUZPZ-UHFFFAOYSA-N
XLogP3.86
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2,6-dipropylphenol?
The IUPAC name of 4-ethyl-2,6-dipropylphenol (CID 66879596) is 4-ethyl-2,6-dipropylphenol.
What is the SMILES notation for 4-ethyl-2,6-dipropylphenol?
The canonical SMILES for 4-ethyl-2,6-dipropylphenol is CCCc1cc(CC)cc(CCC)c1O.
What is the InChIKey of 4-ethyl-2,6-dipropylphenol?
The InChIKey is ZCPIQEPQEVUZPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O/c1-4-7-12-9-11(6-3)10-13(8-5-2)14(12)15/h9-10,15H,4-8H2,1-3H3.
What are the key properties of 4-ethyl-2,6-dipropylphenol?
4-ethyl-2,6-dipropylphenol has a molecular weight of 206.33 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2,6-dipropylphenol is sourced from PubChem (CID 66879596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).