2-(2,6-diethylphenyl)propan-2-ol

C13H20O — CID 117283274

IUPAC2-(2,6-diethylphenyl)propan-2-ol
SMILESCCc1cccc(CC)c1C(C)(C)O
InChIInChI=1S/C13H20O/c1-5-10-8-7-9-11(6-2)12(10)13(3,4)14/h7-9,14H,5-6H2,1-4H3
InChIKeyNNXXKERAPBBPJS-UHFFFAOYSA-N
MW192.30 g/mol
LogP3.04
Rot. Bonds3

About 2-(2,6-diethylphenyl)propan-2-ol

2-(2,6-diethylphenyl)propan-2-ol (PubChem CID 117283274) has the molecular formula C13H20O and a molecular weight of 192.30 g/mol. Its IUPAC name is 2-(2,6-diethylphenyl)propan-2-ol.

Molecular Properties

Compound Name2-(2,6-diethylphenyl)propan-2-ol
PubChem CID117283274
Molecular FormulaC13H20O
Molecular Weight192.30 g/mol
Exact Mass192.15
IUPAC Name2-(2,6-diethylphenyl)propan-2-ol
SMILESCCc1cccc(CC)c1C(C)(C)O
InChIInChI=1S/C13H20O/c1-5-10-8-7-9-11(6-2)12(10)13(3,4)14/h7-9,14H,5-6H2,1-4H3
InChIKeyNNXXKERAPBBPJS-UHFFFAOYSA-N
XLogP3.04
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.30
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-tert-butyl-3-ethylphenyl)methanol
CID 158088532
2-(2-ethylphenyl)propan-2-ol
CID 11958936
1,3-diethyl-2-(trifluoromethyl)benzene
CID 91552460
2-tert-butyl-1-ethyl-3-iodobenzene
CID 146636701
3-ethyl-2-(2-hydroxypropan-2-yl)-6-methoxyphenol
CID 84677805
[2,2-bis(2,6-diethylphenyl)-2-(dimethylamino)ethyl]-trihydroxyphosphanium
CID 172753258
2-ethyl-6-(3-ethyl-2-hydroxyphenyl)phenol
CID 14783606
1-[3-ethyl-2-(trifluoromethyl)phenyl]propan-2-one
CID 118835917
1-(2,6-diethylanilino)-2-methylbutan-2-ol
CID 114493054
1-chloro-3-ethyl-2-(trifluoromethyl)benzene
CID 71072896
bis(2,6-diethylphenol);1,4-xylene
CID 160641052
3-ethyl-2-hydroxybenzenesulfonic acid
CID 19033634

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-diethylphenyl)propan-2-ol?
The IUPAC name of 2-(2,6-diethylphenyl)propan-2-ol (CID 117283274) is 2-(2,6-diethylphenyl)propan-2-ol.
What is the SMILES notation for 2-(2,6-diethylphenyl)propan-2-ol?
The canonical SMILES for 2-(2,6-diethylphenyl)propan-2-ol is CCc1cccc(CC)c1C(C)(C)O.
What is the InChIKey of 2-(2,6-diethylphenyl)propan-2-ol?
The InChIKey is NNXXKERAPBBPJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O/c1-5-10-8-7-9-11(6-2)12(10)13(3,4)14/h7-9,14H,5-6H2,1-4H3.
What are the key properties of 2-(2,6-diethylphenyl)propan-2-ol?
2-(2,6-diethylphenyl)propan-2-ol has a molecular weight of 192.30 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-diethylphenyl)propan-2-ol is sourced from PubChem (CID 117283274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).