3-decyl-4-ethyl-2-phenylphenol

C24H34O — CID 66867433

IUPAC3-decyl-4-ethyl-2-phenylphenol
SMILESCCCCCCCCCCc1c(CC)ccc(O)c1-c1ccccc1
InChIInChI=1S/C24H34O/c1-3-5-6-7-8-9-10-14-17-22-20(4-2)18-19-23(25)24(22)21-15-12-11-13-16-21/h11-13,15-16,18-19,25H,3-10,14,17H2,1-2H3
InChIKeyIYNAQCDLCSSGQK-UHFFFAOYSA-N
MW338.54 g/mol
LogP7.30
Rot. Bonds11

About 3-decyl-4-ethyl-2-phenylphenol

3-decyl-4-ethyl-2-phenylphenol (PubChem CID 66867433) has the molecular formula C24H34O and a molecular weight of 338.54 g/mol. Its IUPAC name is 3-decyl-4-ethyl-2-phenylphenol.

Molecular Properties

Compound Name3-decyl-4-ethyl-2-phenylphenol
PubChem CID66867433
Molecular FormulaC24H34O
Molecular Weight338.54 g/mol
Exact Mass338.26
IUPAC Name3-decyl-4-ethyl-2-phenylphenol
SMILESCCCCCCCCCCc1c(CC)ccc(O)c1-c1ccccc1
InChIInChI=1S/C24H34O/c1-3-5-6-7-8-9-10-14-17-22-20(4-2)18-19-23(25)24(22)21-15-12-11-13-16-21/h11-13,15-16,18-19,25H,3-10,14,17H2,1-2H3
InChIKeyIYNAQCDLCSSGQK-UHFFFAOYSA-N
XLogP7.30
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.54
LogP ≤ 57.30
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

4-heptyl-3-nonyl-2-phenylphenol
CID 66865847
3-decyl-4-pentyl-2-phenylphenol
CID 66867188
4-ethyl-3-hexyl-2-octylphenol
CID 66866506
4-ethyl-2-heptyl-3-pentylphenol
CID 66865655
3,4-dibutyl-2-phenylphenol;hydroxy-[hydroxy(oxo)phosphaniumyl]oxy-oxophosphanium
CID 87504446
4-ethyl-3-heptyl-2-(2-phenylpropan-2-yl)phenol
CID 66867781
2-dodecyl-4-ethyl-3-propylphenol
CID 66867159
3-ethyl-2-octylphenol
CID 66867297
3-butyl-4-ethyl-2-pentylphenol
CID 66866292
2-hexyl-4-phenylbenzene-1,3-diol
CID 23109189
2-phenyl-3-propylbenzene-1,4-diol
CID 118690325
2-phenyl-3-(9-phenylnonyl)benzene-1,4-diol
CID 175071172

Frequently Asked Questions

What is the IUPAC name of 3-decyl-4-ethyl-2-phenylphenol?
The IUPAC name of 3-decyl-4-ethyl-2-phenylphenol (CID 66867433) is 3-decyl-4-ethyl-2-phenylphenol.
What is the SMILES notation for 3-decyl-4-ethyl-2-phenylphenol?
The canonical SMILES for 3-decyl-4-ethyl-2-phenylphenol is CCCCCCCCCCc1c(CC)ccc(O)c1-c1ccccc1.
What is the InChIKey of 3-decyl-4-ethyl-2-phenylphenol?
The InChIKey is IYNAQCDLCSSGQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34O/c1-3-5-6-7-8-9-10-14-17-22-20(4-2)18-19-23(25)24(22)21-15-12-11-13-16-21/h11-13,15-16,18-19,25H,3-10,14,17H2,1-2H3.
What are the key properties of 3-decyl-4-ethyl-2-phenylphenol?
3-decyl-4-ethyl-2-phenylphenol has a molecular weight of 338.54 g/mol, XLogP of 7.30, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-decyl-4-ethyl-2-phenylphenol is sourced from PubChem (CID 66867433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).