2,6-diethyl-3-phenylphenol

C16H18O — CID 101302345

IUPAC2,6-diethyl-3-phenylphenol
SMILESCCc1ccc(-c2ccccc2)c(CC)c1O
InChIInChI=1S/C16H18O/c1-3-12-10-11-15(14(4-2)16(12)17)13-8-6-5-7-9-13/h5-11,17H,3-4H2,1-2H3
InChIKeyPQPHMLCNJDAVMU-UHFFFAOYSA-N
MW226.32 g/mol
LogP4.18
Rot. Bonds3

About 2,6-diethyl-3-phenylphenol

2,6-diethyl-3-phenylphenol (PubChem CID 101302345) has the molecular formula C16H18O and a molecular weight of 226.32 g/mol. Its IUPAC name is 2,6-diethyl-3-phenylphenol.

Molecular Properties

Compound Name2,6-diethyl-3-phenylphenol
PubChem CID101302345
Molecular FormulaC16H18O
Molecular Weight226.32 g/mol
Exact Mass226.14
IUPAC Name2,6-diethyl-3-phenylphenol
SMILESCCc1ccc(-c2ccccc2)c(CC)c1O
InChIInChI=1S/C16H18O/c1-3-12-10-11-15(14(4-2)16(12)17)13-8-6-5-7-9-13/h5-11,17H,3-4H2,1-2H3
InChIKeyPQPHMLCNJDAVMU-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

2,6-diethyl-3-(3-hydroxyphenyl)phenol
CID 101302678
2,3,6-triethyl-5-phenylphenol
CID 101302393
2,3-diethyl-1,4-diphenylbenzene
CID 59383229
2-(2,4-diethyl-3-hydroxyphenyl)benzene-1,3-diol
CID 101303262
ethoxyethane;1,2,3-triethyl-4-phenylbenzene
CID 66697424
ethane;3-ethyl-2-fluoro-6-phenylphenol
CID 145394712
2-ethyl-3-phenylphenol;formaldehyde
CID 175490561
4-(2,3,4-triethylphenyl)phenol
CID 101302516
1,2-diethyl-3-phenylbenzene;oxalonitrile
CID 174716651
2,3-diethyl-5-phenylbenzene-1,4-diol
CID 23109186
bis[(2,3-diethyl-4-phenylphenyl)methoxy]-oxophosphanium
CID 66871039
1,3-dibutyl-2-ethyl-4-(4-phenylphenyl)benzene
CID 150071734

Frequently Asked Questions

What is the IUPAC name of 2,6-diethyl-3-phenylphenol?
The IUPAC name of 2,6-diethyl-3-phenylphenol (CID 101302345) is 2,6-diethyl-3-phenylphenol.
What is the SMILES notation for 2,6-diethyl-3-phenylphenol?
The canonical SMILES for 2,6-diethyl-3-phenylphenol is CCc1ccc(-c2ccccc2)c(CC)c1O.
What is the InChIKey of 2,6-diethyl-3-phenylphenol?
The InChIKey is PQPHMLCNJDAVMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O/c1-3-12-10-11-15(14(4-2)16(12)17)13-8-6-5-7-9-13/h5-11,17H,3-4H2,1-2H3.
What are the key properties of 2,6-diethyl-3-phenylphenol?
2,6-diethyl-3-phenylphenol 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 2,6-diethyl-3-phenylphenol is sourced from PubChem (CID 101302345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).