2-(2,4-diethylphenyl)-3,5-diethylphenol

C20H26O — CID 141260398

IUPAC2-(2,4-diethylphenyl)-3,5-diethylphenol
SMILESCCc1ccc(-c2c(O)cc(CC)cc2CC)c(CC)c1
InChIInChI=1S/C20H26O/c1-5-14-9-10-18(16(7-3)11-14)20-17(8-4)12-15(6-2)13-19(20)21/h9-13,21H,5-8H2,1-4H3
InChIKeyAANTVHCABIHHIQ-UHFFFAOYSA-N
MW282.43 g/mol
LogP5.31
Rot. Bonds5

About 2-(2,4-diethylphenyl)-3,5-diethylphenol

2-(2,4-diethylphenyl)-3,5-diethylphenol (PubChem CID 141260398) has the molecular formula C20H26O and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-(2,4-diethylphenyl)-3,5-diethylphenol.

Molecular Properties

Compound Name2-(2,4-diethylphenyl)-3,5-diethylphenol
PubChem CID141260398
Molecular FormulaC20H26O
Molecular Weight282.43 g/mol
Exact Mass282.20
IUPAC Name2-(2,4-diethylphenyl)-3,5-diethylphenol
SMILESCCc1ccc(-c2c(O)cc(CC)cc2CC)c(CC)c1
InChIInChI=1S/C20H26O/c1-5-14-9-10-18(16(7-3)11-14)20-17(8-4)12-15(6-2)13-19(20)21/h9-13,21H,5-8H2,1-4H3
InChIKeyAANTVHCABIHHIQ-UHFFFAOYSA-N
XLogP5.31
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.43
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(2,4-diethyl-6-hydroxyphenyl)benzene-1,3-diol
CID 101303228
4-(2,4-diethylphenyl)-6-ethylbenzene-1,3-diol
CID 101302857
5-ethyl-2-(4-hydroxyphenyl)phenol
CID 101302542
2,4-diethyl-1-(4-ethylphenyl)benzene
CID 102240206
4-(2,4-dihydroxyphenyl)-5-ethylbenzene-1,3-diol
CID 142760794
4-(2,5-diethylphenyl)-5-ethylbenzene-1,2-diol
CID 101302822
(2,4-diethylphenyl)methanol
CID 21414896
1-(2,4,6-triethylphenyl)-4-[4-(2,4,6-triethylphenyl)naphthalen-1-yl]naphthalene
CID 102266833
3-ethyl-2-(2-ethyl-4-hydroxyphenyl)phenol
CID 101302728
2-(2,5-diethylphenyl)-3-ethylbenzene-1,4-diol
CID 101302876
2-ethyl-1,4-bis(4-ethylphenyl)benzene
CID 157074789
3-ethyl-6-(3-ethylphenyl)benzene-1,2-diol
CID 101302583

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-diethylphenyl)-3,5-diethylphenol?
The IUPAC name of 2-(2,4-diethylphenyl)-3,5-diethylphenol (CID 141260398) is 2-(2,4-diethylphenyl)-3,5-diethylphenol.
What is the SMILES notation for 2-(2,4-diethylphenyl)-3,5-diethylphenol?
The canonical SMILES for 2-(2,4-diethylphenyl)-3,5-diethylphenol is CCc1ccc(-c2c(O)cc(CC)cc2CC)c(CC)c1.
What is the InChIKey of 2-(2,4-diethylphenyl)-3,5-diethylphenol?
The InChIKey is AANTVHCABIHHIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26O/c1-5-14-9-10-18(16(7-3)11-14)20-17(8-4)12-15(6-2)13-19(20)21/h9-13,21H,5-8H2,1-4H3.
What are the key properties of 2-(2,4-diethylphenyl)-3,5-diethylphenol?
2-(2,4-diethylphenyl)-3,5-diethylphenol has a molecular weight of 282.43 g/mol, XLogP of 5.31, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-diethylphenyl)-3,5-diethylphenol is sourced from PubChem (CID 141260398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).