3-(2,3-diethylphenyl)phenol

C16H18O — CID 101302379

IUPAC3-(2,3-diethylphenyl)phenol
SMILESCCc1cccc(-c2cccc(O)c2)c1CC
InChIInChI=1S/C16H18O/c1-3-12-7-6-10-16(15(12)4-2)13-8-5-9-14(17)11-13/h5-11,17H,3-4H2,1-2H3
InChIKeyVRPVGDDBNBTRAU-UHFFFAOYSA-N
MW226.32 g/mol
LogP4.18
Rot. Bonds3

About 3-(2,3-diethylphenyl)phenol

3-(2,3-diethylphenyl)phenol (PubChem CID 101302379) has the molecular formula C16H18O and a molecular weight of 226.32 g/mol. Its IUPAC name is 3-(2,3-diethylphenyl)phenol.

Molecular Properties

Compound Name3-(2,3-diethylphenyl)phenol
PubChem CID101302379
Molecular FormulaC16H18O
Molecular Weight226.32 g/mol
Exact Mass226.14
IUPAC Name3-(2,3-diethylphenyl)phenol
SMILESCCc1cccc(-c2cccc(O)c2)c1CC
InChIInChI=1S/C16H18O/c1-3-12-7-6-10-16(15(12)4-2)13-8-5-9-14(17)11-13/h5-11,17H,3-4H2,1-2H3
InChIKeyVRPVGDDBNBTRAU-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
3-(2,3,6-triethylphenyl)phenol
CID 101302512
1,2-diethyl-3-phenylbenzene;oxalonitrile
CID 174716651
4-(2,3-diethylphenyl)benzene-1,2-diol;formamide
CID 118275219
4,6-diethyl-3-(3-hydroxyphenyl)benzene-1,2-diol
CID 101303164
3-(5-chloro-2-ethylphenyl)phenol
CID 142314632
2-(2,3-diethylphenyl)-3-ethylphenol
CID 101302469
1,2-diethyl-3-phenylbenzene;formamide
CID 90113659
2-ethyl-4-(3-hydroxyphenyl)phenol
CID 101302560
5-(2-ethylphenyl)benzene-1,3-diol
CID 101302537
2,3,5-triethyl-6-(3-hydroxyphenyl)benzene-1,4-diol
CID 101303425
4-(2-ethyl-3-hydroxyphenyl)benzene-1,2-diol
CID 101303074

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-diethylphenyl)phenol?
The IUPAC name of 3-(2,3-diethylphenyl)phenol (CID 101302379) is 3-(2,3-diethylphenyl)phenol.
What is the SMILES notation for 3-(2,3-diethylphenyl)phenol?
The canonical SMILES for 3-(2,3-diethylphenyl)phenol is CCc1cccc(-c2cccc(O)c2)c1CC.
What is the InChIKey of 3-(2,3-diethylphenyl)phenol?
The InChIKey is VRPVGDDBNBTRAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O/c1-3-12-7-6-10-16(15(12)4-2)13-8-5-9-14(17)11-13/h5-11,17H,3-4H2,1-2H3.
What are the key properties of 3-(2,3-diethylphenyl)phenol?
3-(2,3-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 3-(2,3-diethylphenyl)phenol is sourced from PubChem (CID 101302379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).