2,6-diethyl-4-pentylphenol

C15H24O — CID 66879488

IUPAC2,6-diethyl-4-pentylphenol
SMILESCCCCCc1cc(CC)c(O)c(CC)c1
InChIInChI=1S/C15H24O/c1-4-7-8-9-12-10-13(5-2)15(16)14(6-3)11-12/h10-11,16H,4-9H2,1-3H3
InChIKeyLPVCACGMEHZJOY-UHFFFAOYSA-N
MW220.36 g/mol
LogP4.25
Rot. Bonds6

About 2,6-diethyl-4-pentylphenol

2,6-diethyl-4-pentylphenol (PubChem CID 66879488) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 2,6-diethyl-4-pentylphenol.

Molecular Properties

Compound Name2,6-diethyl-4-pentylphenol
PubChem CID66879488
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name2,6-diethyl-4-pentylphenol
SMILESCCCCCc1cc(CC)c(O)c(CC)c1
InChIInChI=1S/C15H24O/c1-4-7-8-9-12-10-13(5-2)15(16)14(6-3)11-12/h10-11,16H,4-9H2,1-3H3
InChIKeyLPVCACGMEHZJOY-UHFFFAOYSA-N
XLogP4.25
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-butyl-6-ethyl-4-pentylphenol
CID 66879170
2-ethyl-4-heptyl-6-pentylphenol
CID 66879967
2-ethyl-6-pentyl-4-propylphenol
CID 66878892
2,4,6-triheptylphenol
CID 139692303
2-[(3-ethyl-2-hydroxy-5-octylphenyl)methyl]-6-methyl-4-pentylphenol
CID 20741015
4-butyl-2,6-didodecylphenol
CID 66619638
2-butyl-4-pentyl-6-propylphenol
CID 66878895
2,6-bis(2-methylpropyl)-4-nonylphenol
CID 126622784
2-[[2-hydroxy-3-(hydroxymethyl)-5-nonylphenyl]methyl]-6-(hydroxymethyl)-4-nonylphenol
CID 118909015
2,4,6-tributylphenol;zirconium(2+);dichloride
CID 174692892
2,6-dimethyl-4-pentylphenol
CID 22625507
2,4,6-tris[10-(didecylamino)decyl]phenol
CID 150630687

Frequently Asked Questions

What is the IUPAC name of 2,6-diethyl-4-pentylphenol?
The IUPAC name of 2,6-diethyl-4-pentylphenol (CID 66879488) is 2,6-diethyl-4-pentylphenol.
What is the SMILES notation for 2,6-diethyl-4-pentylphenol?
The canonical SMILES for 2,6-diethyl-4-pentylphenol is CCCCCc1cc(CC)c(O)c(CC)c1.
What is the InChIKey of 2,6-diethyl-4-pentylphenol?
The InChIKey is LPVCACGMEHZJOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-4-7-8-9-12-10-13(5-2)15(16)14(6-3)11-12/h10-11,16H,4-9H2,1-3H3.
What are the key properties of 2,6-diethyl-4-pentylphenol?
2,6-diethyl-4-pentylphenol has a molecular weight of 220.36 g/mol, XLogP of 4.25, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diethyl-4-pentylphenol is sourced from PubChem (CID 66879488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).