2-(cyclohexylmethoxy)oxane

C12H22O2 — CID 13184695

IUPAC2-(cyclohexylmethoxy)oxane
SMILESC1CCC(COC2CCCCO2)CC1
InChIInChI=1S/C12H22O2/c1-2-6-11(7-3-1)10-14-12-8-4-5-9-13-12/h11-12H,1-10H2
InChIKeyVRLFZNMAJKLLPK-UHFFFAOYSA-N
MW198.31 g/mol
LogP3.11
Rot. Bonds3

About 2-(cyclohexylmethoxy)oxane

2-(cyclohexylmethoxy)oxane (PubChem CID 13184695) has the molecular formula C12H22O2 and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-(cyclohexylmethoxy)oxane.

Molecular Properties

Compound Name2-(cyclohexylmethoxy)oxane
PubChem CID13184695
Molecular FormulaC12H22O2
Molecular Weight198.31 g/mol
Exact Mass198.16
IUPAC Name2-(cyclohexylmethoxy)oxane
SMILESC1CCC(COC2CCCCO2)CC1
InChIInChI=1S/C12H22O2/c1-2-6-11(7-3-1)10-14-12-8-4-5-9-13-12/h11-12H,1-10H2
InChIKeyVRLFZNMAJKLLPK-UHFFFAOYSA-N
XLogP3.11
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Cyclohexyl-1,3-dioxane
CID 11344247
Cyclohexane, (diethoxymethyl)-
CID 10943197
(2,2-Diethoxyethyl)cyclohexane
CID 13163948
2-(2-Cyclohexylethyl)-1,3-dioxane
CID 13801295
2-(4-Fluorocyclohexyl)-5-pentyl-1,3-dioxane
CID 189247
5-Ethyl-2-(4-fluorocyclohexyl)-1,3-dioxane
CID 70491938
2-(4-Fluorocyclohexyl)-5-propyl-1,3-dioxane
CID 70492415
5-Butyl-2-(4-fluorocyclohexyl)-1,3-dioxane
CID 70493724
5-Methyl-2-(3,4,5-trifluorocyclohexyl)-1,3-dioxane
CID 117705464
2-(1-Methylcyclohexyloxy)-tetrahydropyran
CID 559167
Hexahydro-2H,5H-pyrano(2,3-b)pyran
CID 588023
2-Cyclohexyl-5,5-dimethyl-1,3-dioxane
CID 12064939

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylmethoxy)oxane?
The IUPAC name of 2-(cyclohexylmethoxy)oxane (CID 13184695) is 2-(cyclohexylmethoxy)oxane.
What is the SMILES notation for 2-(cyclohexylmethoxy)oxane?
The canonical SMILES for 2-(cyclohexylmethoxy)oxane is C1CCC(COC2CCCCO2)CC1.
What is the InChIKey of 2-(cyclohexylmethoxy)oxane?
The InChIKey is VRLFZNMAJKLLPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O2/c1-2-6-11(7-3-1)10-14-12-8-4-5-9-13-12/h11-12H,1-10H2.
What are the key properties of 2-(cyclohexylmethoxy)oxane?
2-(cyclohexylmethoxy)oxane has a molecular weight of 198.31 g/mol, XLogP of 3.11, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylmethoxy)oxane is sourced from PubChem (CID 13184695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).