3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol

C15H26O — CID 143329110

IUPAC3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol
SMILESCC1CC2C(C)CC3(O)CC(C)C(C1)C2C3
InChIInChI=1S/C15H26O/c1-9-4-12-10(2)6-15(16)7-11(3)13(5-9)14(12)8-15/h9-14,16H,4-8H2,1-3H3
InChIKeyKREGSEDZGWWWLZ-UHFFFAOYSA-N
MW222.37 g/mol
LogP3.47
Rot. Bonds

About 3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol

3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol (PubChem CID 143329110) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is 3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol.

Molecular Properties

Compound Name3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol
PubChem CID143329110
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol
SMILESCC1CC2C(C)CC3(O)CC(C)C(C1)C2C3
InChIInChI=1S/C15H26O/c1-9-4-12-10(2)6-15(16)7-11(3)13(5-9)14(12)8-15/h9-14,16H,4-8H2,1-3H3
InChIKeyKREGSEDZGWWWLZ-UHFFFAOYSA-N
XLogP3.47
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.37
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyltricyclo[5.2.1.03,9]decan-7-ol
CID 89023602
4-methyltricyclo[3.3.1.03,7]nonan-1-ol
CID 123795374
3-methylbicyclo[3.1.1]heptan-1-ol
CID 67034776
7-methyltricyclo[3.3.0.02,4]octane
CID 154523020
2-(2,5-dimethylcyclohexyl)-1,4-dimethylcyclohexane
CID 91483098
2,5-dimethylbicyclo[2.2.0]hexane
CID 91558991
4,9,9-trimethyltricyclo[5.3.1.02,6]undecane
CID 142004416
(1R,3aR,4S,6S,7aR)-3,3,6-trimethyl-1,2,3a,4,5,6,7,7a-octahydroindene-1,4-diol
CID 10559883
(1S,2S,4R,5R)-2,4-dimethylbicyclo[3.1.0]hexane
CID 172607830
(5S)-2,4-dimethylbicyclo[3.1.0]hexane
CID 142062990
methane;1,2,4-trimethylcyclopentane
CID 157268000
2-methylcyclopropane-1,1-diol
CID 68932442

Frequently Asked Questions

What is the IUPAC name of 3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol?
The IUPAC name of 3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol (CID 143329110) is 3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol.
What is the SMILES notation for 3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol?
The canonical SMILES for 3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol is CC1CC2C(C)CC3(O)CC(C)C(C1)C2C3.
What is the InChIKey of 3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol?
The InChIKey is KREGSEDZGWWWLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O/c1-9-4-12-10(2)6-15(16)7-11(3)13(5-9)14(12)8-15/h9-14,16H,4-8H2,1-3H3.
What are the key properties of 3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol?
3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol has a molecular weight of 222.37 g/mol, XLogP of 3.47, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6,12-trimethyltricyclo[6.2.2.04,9]dodecan-1-ol is sourced from PubChem (CID 143329110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).