3,4-diethyl-5-(4-hydroxyphenyl)phenol

C16H18O2 — CID 101302689

IUPAC3,4-diethyl-5-(4-hydroxyphenyl)phenol
SMILESCCc1cc(O)cc(-c2ccc(O)cc2)c1CC
InChIInChI=1S/C16H18O2/c1-3-11-9-14(18)10-16(15(11)4-2)12-5-7-13(17)8-6-12/h5-10,17-18H,3-4H2,1-2H3
InChIKeyODFNEZWCFVBKFR-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.89
Rot. Bonds3

About 3,4-diethyl-5-(4-hydroxyphenyl)phenol

3,4-diethyl-5-(4-hydroxyphenyl)phenol (PubChem CID 101302689) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 3,4-diethyl-5-(4-hydroxyphenyl)phenol.

Molecular Properties

Compound Name3,4-diethyl-5-(4-hydroxyphenyl)phenol
PubChem CID101302689
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name3,4-diethyl-5-(4-hydroxyphenyl)phenol
SMILESCCc1cc(O)cc(-c2ccc(O)cc2)c1CC
InChIInChI=1S/C16H18O2/c1-3-11-9-14(18)10-16(15(11)4-2)12-5-7-13(17)8-6-12/h5-10,17-18H,3-4H2,1-2H3
InChIKeyODFNEZWCFVBKFR-UHFFFAOYSA-N
XLogP3.89
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2,3-diethyl-5-hydroxyphenyl)benzene-1,3-diol
CID 101303299
4-(2,3,4-triethylphenyl)phenol
CID 101302516
2-ethyl-6-(4-ethylphenyl)benzene-1,4-diol
CID 101302621
4-(5-bromo-2-ethylphenyl)phenol
CID 174859621
4-(4-bromo-2-ethylphenyl)phenol
CID 118355100
2,3,6-triethyl-5-phenylphenol
CID 101302393
4,6-diethyl-5-(4-hydroxyphenyl)benzene-1,3-diol
CID 101303207
5-(2,3,5-triethyl-6-hydroxyphenyl)benzene-1,3-diol
CID 101303488
5-(3,4,6-triethyl-2-hydroxyphenyl)benzene-1,3-diol
CID 101303487
(2-ethyl-3,5-diphenylphenyl)methanol
CID 172831551
2-(2,3,4-triethylphenyl)benzene-1,4-diol
CID 101302922
4-(2,3,4-triethyl-6-hydroxyphenyl)benzene-1,3-diol
CID 101303449

Frequently Asked Questions

What is the IUPAC name of 3,4-diethyl-5-(4-hydroxyphenyl)phenol?
The IUPAC name of 3,4-diethyl-5-(4-hydroxyphenyl)phenol (CID 101302689) is 3,4-diethyl-5-(4-hydroxyphenyl)phenol.
What is the SMILES notation for 3,4-diethyl-5-(4-hydroxyphenyl)phenol?
The canonical SMILES for 3,4-diethyl-5-(4-hydroxyphenyl)phenol is CCc1cc(O)cc(-c2ccc(O)cc2)c1CC.
What is the InChIKey of 3,4-diethyl-5-(4-hydroxyphenyl)phenol?
The InChIKey is ODFNEZWCFVBKFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c1-3-11-9-14(18)10-16(15(11)4-2)12-5-7-13(17)8-6-12/h5-10,17-18H,3-4H2,1-2H3.
What are the key properties of 3,4-diethyl-5-(4-hydroxyphenyl)phenol?
3,4-diethyl-5-(4-hydroxyphenyl)phenol has a molecular weight of 242.32 g/mol, XLogP of 3.89, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-diethyl-5-(4-hydroxyphenyl)phenol is sourced from PubChem (CID 101302689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).