cyclohexyloxycyclohexane;oxane

C17H32O2 — CID 174738256

IUPACcyclohexyloxycyclohexane;oxane
SMILESC1CCC(OC2CCCCC2)CC1.C1CCOCC1
InChIInChI=1S/C12H22O.C5H10O/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-2-4-6-5-3-1/h11-12H,1-10H2;1-5H2
InChIKeyJIWCEKJBLDRMIF-UHFFFAOYSA-N
MW268.44 g/mol
LogP4.86
Rot. Bonds2

About cyclohexyloxycyclohexane;oxane

cyclohexyloxycyclohexane;oxane (PubChem CID 174738256) has the molecular formula C17H32O2 and a molecular weight of 268.44 g/mol. Its IUPAC name is cyclohexyloxycyclohexane;oxane.

Molecular Properties

Compound Namecyclohexyloxycyclohexane;oxane
PubChem CID174738256
Molecular FormulaC17H32O2
Molecular Weight268.44 g/mol
Exact Mass268.24
IUPAC Namecyclohexyloxycyclohexane;oxane
SMILESC1CCC(OC2CCCCC2)CC1.C1CCOCC1
InChIInChI=1S/C12H22O.C5H10O/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-2-4-6-5-3-1/h11-12H,1-10H2;1-5H2
InChIKeyJIWCEKJBLDRMIF-UHFFFAOYSA-N
XLogP4.86
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclohexyloxycyclohexane;oxane?
The IUPAC name of cyclohexyloxycyclohexane;oxane (CID 174738256) is cyclohexyloxycyclohexane;oxane.
What is the SMILES notation for cyclohexyloxycyclohexane;oxane?
The canonical SMILES for cyclohexyloxycyclohexane;oxane is C1CCC(OC2CCCCC2)CC1.C1CCOCC1.
What is the InChIKey of cyclohexyloxycyclohexane;oxane?
The InChIKey is JIWCEKJBLDRMIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O.C5H10O/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-2-4-6-5-3-1/h11-12H,1-10H2;1-5H2.
What are the key properties of cyclohexyloxycyclohexane;oxane?
cyclohexyloxycyclohexane;oxane has a molecular weight of 268.44 g/mol, XLogP of 4.86, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyloxycyclohexane;oxane is sourced from PubChem (CID 174738256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).