4-(2,6-diethylphenyl)phenol

C16H18O — CID 21281287

IUPAC4-(2,6-diethylphenyl)phenol
SMILESCCc1cccc(CC)c1-c1ccc(O)cc1
InChIInChI=1S/C16H18O/c1-3-12-6-5-7-13(4-2)16(12)14-8-10-15(17)11-9-14/h5-11,17H,3-4H2,1-2H3
InChIKeyVRPYSOMDVFTBPV-UHFFFAOYSA-N
MW226.32 g/mol
LogP4.18
Rot. Bonds3

About 4-(2,6-diethylphenyl)phenol

4-(2,6-diethylphenyl)phenol (PubChem CID 21281287) has the molecular formula C16H18O and a molecular weight of 226.32 g/mol. Its IUPAC name is 4-(2,6-diethylphenyl)phenol.

Molecular Properties

Compound Name4-(2,6-diethylphenyl)phenol
PubChem CID21281287
Molecular FormulaC16H18O
Molecular Weight226.32 g/mol
Exact Mass226.14
IUPAC Name4-(2,6-diethylphenyl)phenol
SMILESCCc1cccc(CC)c1-c1ccc(O)cc1
InChIInChI=1S/C16H18O/c1-3-12-6-5-7-13(4-2)16(12)14-8-10-15(17)11-9-14/h5-11,17H,3-4H2,1-2H3
InChIKeyVRPYSOMDVFTBPV-UHFFFAOYSA-N
XLogP4.18
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[2-(aminomethyl)-6-propylphenyl]phenol
CID 151399870
1-ethyl-2-methylbenzene;4-(4-hydroxyphenyl)phenol
CID 174751633
4-(2,6-diethylphenyl)-2-methylphenol
CID 154385947
4-ethyl-2-hydroxy-3-(4-hydroxyphenyl)benzamide
CID 174769014
3-ethyl-2-(2-ethyl-4-hydroxyphenyl)phenol
CID 101302728
4-(3-ethyl-2-methyl-6-phenylphenyl)phenol
CID 139603227
1-(2,6-diethylphenyl)ethanone
CID 14939611
bis(2,6-diethylphenol);1,4-xylene
CID 160641052
2-ethyl-4-(3-hydroxyphenyl)phenol
CID 101302560
2-ethyl-6-(4-ethylphenyl)phenol
CID 101302359
4,6-diethyl-5-(4-hydroxyphenyl)benzene-1,3-diol
CID 101303207
1,5-bis[2-(4-hydroxyphenyl)-3-methoxyphenyl]pentane-2,4-dione
CID 23093450

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-diethylphenyl)phenol?
The IUPAC name of 4-(2,6-diethylphenyl)phenol (CID 21281287) is 4-(2,6-diethylphenyl)phenol.
What is the SMILES notation for 4-(2,6-diethylphenyl)phenol?
The canonical SMILES for 4-(2,6-diethylphenyl)phenol is CCc1cccc(CC)c1-c1ccc(O)cc1.
What is the InChIKey of 4-(2,6-diethylphenyl)phenol?
The InChIKey is VRPYSOMDVFTBPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O/c1-3-12-6-5-7-13(4-2)16(12)14-8-10-15(17)11-9-14/h5-11,17H,3-4H2,1-2H3.
What are the key properties of 4-(2,6-diethylphenyl)phenol?
4-(2,6-diethylphenyl)phenol has a molecular weight of 226.32 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-diethylphenyl)phenol is sourced from PubChem (CID 21281287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).