ethane;4-ethyl-2,6-dimethylphenol

C14H26O — CID 143343408

IUPACethane;4-ethyl-2,6-dimethylphenol
SMILESCC.CC.CCc1cc(C)c(O)c(C)c1
InChIInChI=1S/C10H14O.2C2H6/c1-4-9-5-7(2)10(11)8(3)6-9;2*1-2/h5-6,11H,4H2,1-3H3;2*1-2H3
InChIKeyWBHURMZTVFDWLS-UHFFFAOYSA-N
MW210.36 g/mol
LogP4.62
Rot. Bonds1

About ethane;4-ethyl-2,6-dimethylphenol

ethane;4-ethyl-2,6-dimethylphenol (PubChem CID 143343408) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is ethane;4-ethyl-2,6-dimethylphenol.

Molecular Properties

Compound Nameethane;4-ethyl-2,6-dimethylphenol
PubChem CID143343408
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Nameethane;4-ethyl-2,6-dimethylphenol
SMILESCC.CC.CCc1cc(C)c(O)c(C)c1
InChIInChI=1S/C10H14O.2C2H6/c1-4-9-5-7(2)10(11)8(3)6-9;2*1-2/h5-6,11H,4H2,1-3H3;2*1-2H3
InChIKeyWBHURMZTVFDWLS-UHFFFAOYSA-N
XLogP4.62
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-tert-Pentylphenol
CID 6643
P-Cresol
CID 2879
Thymol
CID 6989
Diethylstilbestrol
CID 448537
O-Cresol
CID 335
Bisphenol A
CID 6623
2,4-Dimethylphenol
CID 7771
2,6-Di-tert-butyl-4-methylphenol
CID 31404
Dienestrol
CID 667476
(1,1'-Biphenyl)-2-ol
CID 7017
4-tert-Butylphenol
CID 7393
Tyrosol
CID 10393

Frequently Asked Questions

What is the IUPAC name of ethane;4-ethyl-2,6-dimethylphenol?
The IUPAC name of ethane;4-ethyl-2,6-dimethylphenol (CID 143343408) is ethane;4-ethyl-2,6-dimethylphenol.
What is the SMILES notation for ethane;4-ethyl-2,6-dimethylphenol?
The canonical SMILES for ethane;4-ethyl-2,6-dimethylphenol is CC.CC.CCc1cc(C)c(O)c(C)c1.
What is the InChIKey of ethane;4-ethyl-2,6-dimethylphenol?
The InChIKey is WBHURMZTVFDWLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O.2C2H6/c1-4-9-5-7(2)10(11)8(3)6-9;2*1-2/h5-6,11H,4H2,1-3H3;2*1-2H3.
What are the key properties of ethane;4-ethyl-2,6-dimethylphenol?
ethane;4-ethyl-2,6-dimethylphenol has a molecular weight of 210.36 g/mol, XLogP of 4.62, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-ethyl-2,6-dimethylphenol is sourced from PubChem (CID 143343408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).