2-[3-(trifluoromethyl)cyclohexyl]oxolane

C11H17F3O — CID 154607706

IUPAC2-[3-(trifluoromethyl)cyclohexyl]oxolane
SMILESFC(F)(F)C1CCCC(C2CCCO2)C1
InChIInChI=1S/C11H17F3O/c12-11(13,14)9-4-1-3-8(7-9)10-5-2-6-15-10/h8-10H,1-7H2
InChIKeyJRNCMPKMXDTKTN-UHFFFAOYSA-N
MW222.25 g/mol
LogP3.53
Rot. Bonds1

About 2-[3-(trifluoromethyl)cyclohexyl]oxolane

2-[3-(trifluoromethyl)cyclohexyl]oxolane (PubChem CID 154607706) has the molecular formula C11H17F3O and a molecular weight of 222.25 g/mol. Its IUPAC name is 2-[3-(trifluoromethyl)cyclohexyl]oxolane.

Molecular Properties

Compound Name2-[3-(trifluoromethyl)cyclohexyl]oxolane
PubChem CID154607706
Molecular FormulaC11H17F3O
Molecular Weight222.25 g/mol
Exact Mass222.12
IUPAC Name2-[3-(trifluoromethyl)cyclohexyl]oxolane
SMILESFC(F)(F)C1CCCC(C2CCCO2)C1
InChIInChI=1S/C11H17F3O/c12-11(13,14)9-4-1-3-8(7-9)10-5-2-6-15-10/h8-10H,1-7H2
InChIKeyJRNCMPKMXDTKTN-UHFFFAOYSA-N
XLogP3.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(Cyclohexylmethyl)oxolane
CID 14027486
Cyclohexyltetrahydrofuran
CID 69429853
2-Cyclohexyl-4-fluorooxolane
CID 12038085
2,2-Difluoro-3-methyl-6-(4-methylcyclohexyl)oxane
CID 54496843
2-Propyl-5-[4-(trifluoromethoxy)cyclohexyl]oxolane
CID 58555466
2-Propyl-5-[4-(trifluoromethyl)cyclohexyl]oxolane
CID 58555665
2-[4-(Difluoromethyl)cyclohexyl]-5-methyloxane
CID 67890084
cis-(2R,4R)-4-butoxy-2-ethyl-1,1-difluorocyclohexane
CID 71047170
2-Fluoro-4-heptan-3-yl-1-(1,2,2,2-tetrafluoroethoxy)cyclohexane
CID 71228162
1-(1,1-Difluoroethyl)-4-(propan-2-yloxymethyl)cyclohexane
CID 118200687
1-[Difluoro(nonan-4-yloxy)methyl]-4-ethylcyclohexane
CID 122536279
5-(1,1-Difluoro-5-methyloctoxy)-1,2,3-trifluorocyclohexane
CID 122676038

Frequently Asked Questions

What is the IUPAC name of 2-[3-(trifluoromethyl)cyclohexyl]oxolane?
The IUPAC name of 2-[3-(trifluoromethyl)cyclohexyl]oxolane (CID 154607706) is 2-[3-(trifluoromethyl)cyclohexyl]oxolane.
What is the SMILES notation for 2-[3-(trifluoromethyl)cyclohexyl]oxolane?
The canonical SMILES for 2-[3-(trifluoromethyl)cyclohexyl]oxolane is FC(F)(F)C1CCCC(C2CCCO2)C1.
What is the InChIKey of 2-[3-(trifluoromethyl)cyclohexyl]oxolane?
The InChIKey is JRNCMPKMXDTKTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F3O/c12-11(13,14)9-4-1-3-8(7-9)10-5-2-6-15-10/h8-10H,1-7H2.
What are the key properties of 2-[3-(trifluoromethyl)cyclohexyl]oxolane?
2-[3-(trifluoromethyl)cyclohexyl]oxolane has a molecular weight of 222.25 g/mol, XLogP of 3.53, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(trifluoromethyl)cyclohexyl]oxolane is sourced from PubChem (CID 154607706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).