2,2-dicyclohexyl-1,3-dioxolane

C15H26O2 — CID 102096003

IUPAC2,2-dicyclohexyl-1,3-dioxolane
SMILESC1CCC(C2(C3CCCCC3)OCCO2)CC1
InChIInChI=1S/C15H26O2/c1-3-7-13(8-4-1)15(16-11-12-17-15)14-9-5-2-6-10-14/h13-14H,1-12H2
InChIKeySVCRFPOLMUKGTH-UHFFFAOYSA-N
MW238.37 g/mol
LogP3.89
Rot. Bonds2

About 2,2-dicyclohexyl-1,3-dioxolane

2,2-dicyclohexyl-1,3-dioxolane (PubChem CID 102096003) has the molecular formula C15H26O2 and a molecular weight of 238.37 g/mol. Its IUPAC name is 2,2-dicyclohexyl-1,3-dioxolane.

Molecular Properties

Compound Name2,2-dicyclohexyl-1,3-dioxolane
PubChem CID102096003
Molecular FormulaC15H26O2
Molecular Weight238.37 g/mol
Exact Mass238.19
IUPAC Name2,2-dicyclohexyl-1,3-dioxolane
SMILESC1CCC(C2(C3CCCCC3)OCCO2)CC1
InChIInChI=1S/C15H26O2/c1-3-7-13(8-4-1)15(16-11-12-17-15)14-9-5-2-6-10-14/h13-14H,1-12H2
InChIKeySVCRFPOLMUKGTH-UHFFFAOYSA-N
XLogP3.89
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclohexyl-2-(dichloromethyl)-1,3-dioxolane
CID 12529863
2-cyclopentyl-2-methyl-1,3-dioxane
CID 45098524
8a-methyl-2,3,4,4a,5,6,7,8-octahydrochromene
CID 58800826
(2R)-2-cyclohexyl-2-methyloxirane
CID 101039402
2-tert-butyl-2-cyclohexyloxolane
CID 177073539
(2-cyclohexyloxolan-2-yl)methanol
CID 130689922
4-methyl-4-spiro[1,3-dioxolane-2,9'-bicyclo[3.3.1]nonane]-2'-ylmorpholin-4-ium;hydroiodide
CID 126960723
4-cyclohexyl-4-methyloxane
CID 58667675
(3aR,7aR)-7a-methyl-3,3a,4,5,6,7-hexahydro-2H-1-benzofuran
CID 11469119
(3aR,7aS)-7a-methyl-3,3a,4,5,6,7-hexahydro-2H-1-benzofuran
CID 124636274
2-(chloromethyl)-2-cyclohexyloxane
CID 126987668
1-(2-cyclotricosyl-oxacyclotetracos-2-yl)cyclotricosan-1-ol
CID 173416726

Frequently Asked Questions

What is the IUPAC name of 2,2-dicyclohexyl-1,3-dioxolane?
The IUPAC name of 2,2-dicyclohexyl-1,3-dioxolane (CID 102096003) is 2,2-dicyclohexyl-1,3-dioxolane.
What is the SMILES notation for 2,2-dicyclohexyl-1,3-dioxolane?
The canonical SMILES for 2,2-dicyclohexyl-1,3-dioxolane is C1CCC(C2(C3CCCCC3)OCCO2)CC1.
What is the InChIKey of 2,2-dicyclohexyl-1,3-dioxolane?
The InChIKey is SVCRFPOLMUKGTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O2/c1-3-7-13(8-4-1)15(16-11-12-17-15)14-9-5-2-6-10-14/h13-14H,1-12H2.
What are the key properties of 2,2-dicyclohexyl-1,3-dioxolane?
2,2-dicyclohexyl-1,3-dioxolane has a molecular weight of 238.37 g/mol, XLogP of 3.89, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dicyclohexyl-1,3-dioxolane is sourced from PubChem (CID 102096003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).