4-ethyl-1,1,2-trimethylcyclohexane

C11H22 — CID 91194488

IUPAC4-ethyl-1,1,2-trimethylcyclohexane
SMILESCCC1CCC(C)(C)C(C)C1
InChIInChI=1S/C11H22/c1-5-10-6-7-11(3,4)9(2)8-10/h9-10H,5-8H2,1-4H3
InChIKeyXLGGTYOFGVDRHK-UHFFFAOYSA-N
MW154.30 g/mol
LogP3.86
Rot. Bonds1

About 4-ethyl-1,1,2-trimethylcyclohexane

4-ethyl-1,1,2-trimethylcyclohexane (PubChem CID 91194488) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is 4-ethyl-1,1,2-trimethylcyclohexane.

Molecular Properties

Compound Name4-ethyl-1,1,2-trimethylcyclohexane
PubChem CID91194488
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name4-ethyl-1,1,2-trimethylcyclohexane
SMILESCCC1CCC(C)(C)C(C)C1
InChIInChI=1S/C11H22/c1-5-10-6-7-11(3,4)9(2)8-10/h9-10H,5-8H2,1-4H3
InChIKeyXLGGTYOFGVDRHK-UHFFFAOYSA-N
XLogP3.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,4-diethyl-1,1-dimethylcyclohexane
CID 143295937
triethyl-(3,4,4-trimethylcyclohexyl)azanium
CID 176650635
(2S)-1,1,2-trimethylcyclobutane
CID 59954523
cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene
CID 177145950
(3R)-7-ethyl-3-methylspiro[3.5]nonane
CID 163822270
acetylene;4-ethyl-1,1-dimethylcyclohexane
CID 142009722
1,3-diethylcyclopentane
CID 530396
N,N,3,4,4-pentamethylcyclohexan-1-amine
CID 91209585
trans-(1R,3R)-1-ethyl-3-methylcyclopentane
CID 6432281
1,4-diethyl-1-methylcyclohexane;ethane
CID 144637328
3-ethyl-1,1,2-trimethylcyclopentane
CID 123564312
2-ethyl-1,1,4,5,5-pentamethylcyclohexane
CID 123866855

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1,1,2-trimethylcyclohexane?
The IUPAC name of 4-ethyl-1,1,2-trimethylcyclohexane (CID 91194488) is 4-ethyl-1,1,2-trimethylcyclohexane.
What is the SMILES notation for 4-ethyl-1,1,2-trimethylcyclohexane?
The canonical SMILES for 4-ethyl-1,1,2-trimethylcyclohexane is CCC1CCC(C)(C)C(C)C1.
What is the InChIKey of 4-ethyl-1,1,2-trimethylcyclohexane?
The InChIKey is XLGGTYOFGVDRHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22/c1-5-10-6-7-11(3,4)9(2)8-10/h9-10H,5-8H2,1-4H3.
What are the key properties of 4-ethyl-1,1,2-trimethylcyclohexane?
4-ethyl-1,1,2-trimethylcyclohexane has a molecular weight of 154.30 g/mol, XLogP of 3.86, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1,1,2-trimethylcyclohexane is sourced from PubChem (CID 91194488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).