2-tert-butyl-2-cyclohexyloxolane

C14H26O — CID 177073539

IUPAC2-tert-butyl-2-cyclohexyloxolane
SMILESCC(C)(C)C1(C2CCCCC2)CCCO1
InChIInChI=1S/C14H26O/c1-13(2,3)14(10-7-11-15-14)12-8-5-4-6-9-12/h12H,4-11H2,1-3H3
InChIKeyCCVFUSURFHVKOD-UHFFFAOYSA-N
MW210.36 g/mol
LogP4.16
Rot. Bonds1

About 2-tert-butyl-2-cyclohexyloxolane

2-tert-butyl-2-cyclohexyloxolane (PubChem CID 177073539) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is 2-tert-butyl-2-cyclohexyloxolane.

Molecular Properties

Compound Name2-tert-butyl-2-cyclohexyloxolane
PubChem CID177073539
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name2-tert-butyl-2-cyclohexyloxolane
SMILESCC(C)(C)C1(C2CCCCC2)CCCO1
InChIInChI=1S/C14H26O/c1-13(2,3)14(10-7-11-15-14)12-8-5-4-6-9-12/h12H,4-11H2,1-3H3
InChIKeyCCVFUSURFHVKOD-UHFFFAOYSA-N
XLogP4.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-tert-butyl-13-oxabicyclo[10.1.0]tridecane
CID 139970626
3-tert-butyl-3-cyclohexyloxane
CID 177073542
8a-methyl-2,3,4,4a,5,6,7,8-octahydrochromene
CID 58800826
2-cyclopentyl-2-methyl-1,3-dioxane
CID 45098524
2,2-dicyclohexyl-1,3-dioxolane
CID 102096003
1-tert-butylbicyclo[4.1.0]heptane
CID 13029060
(2-cyclohexyloxolan-2-yl)methanol
CID 130689922
(3aR,7aS)-7a-methyl-3,3a,4,5,6,7-hexahydro-2H-1-benzofuran
CID 124636274
(3aR,7aR)-7a-methyl-3,3a,4,5,6,7-hexahydro-2H-1-benzofuran
CID 11469119
4-cyclohexyl-4-methyloxane
CID 58667675
(2R)-2-cyclohexyl-2-methyloxirane
CID 101039402
2-cyclopropyl-2-methoxyoxolane
CID 158451522

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-2-cyclohexyloxolane?
The IUPAC name of 2-tert-butyl-2-cyclohexyloxolane (CID 177073539) is 2-tert-butyl-2-cyclohexyloxolane.
What is the SMILES notation for 2-tert-butyl-2-cyclohexyloxolane?
The canonical SMILES for 2-tert-butyl-2-cyclohexyloxolane is CC(C)(C)C1(C2CCCCC2)CCCO1.
What is the InChIKey of 2-tert-butyl-2-cyclohexyloxolane?
The InChIKey is CCVFUSURFHVKOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-13(2,3)14(10-7-11-15-14)12-8-5-4-6-9-12/h12H,4-11H2,1-3H3.
What are the key properties of 2-tert-butyl-2-cyclohexyloxolane?
2-tert-butyl-2-cyclohexyloxolane has a molecular weight of 210.36 g/mol, XLogP of 4.16, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-2-cyclohexyloxolane is sourced from PubChem (CID 177073539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).