6-oxaspiro[4.6]undecane

C10H18O — CID 118210180

IUPAC6-oxaspiro[4.6]undecane
SMILESC1CCOC2(CC1)CCCC2
InChIInChI=1S/C10H18O/c1-2-6-10(11-9-5-1)7-3-4-8-10/h1-9H2
InChIKeyDCKQMLNVTUYSHK-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.89
Rot. Bonds

About 6-oxaspiro[4.6]undecane

6-oxaspiro[4.6]undecane (PubChem CID 118210180) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 6-oxaspiro[4.6]undecane.

Molecular Properties

Compound Name6-oxaspiro[4.6]undecane
PubChem CID118210180
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name6-oxaspiro[4.6]undecane
SMILESC1CCOC2(CC1)CCCC2
InChIInChI=1S/C10H18O/c1-2-6-10(11-9-5-1)7-3-4-8-10/h1-9H2
InChIKeyDCKQMLNVTUYSHK-UHFFFAOYSA-N
XLogP2.89
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,2-Dimethyloxepane
CID 14783826
1-Oxaspiro[6.6]tridecane
CID 20439543
1-Oxaspiro[4.6]undecane
CID 16743008
8-Oxaspiro[4.6]undecane
CID 118209763
(2R)-2-methyl-2-octyloxolane
CID 138962700
1-Oxaspiro[4.11]hexadecane
CID 86183579
2-Hexyl-2-methyloxolane
CID 10964962
1-Ethoxy-1-methylcyclododecane
CID 54241120
1-Ethoxy-1-methylcycloheptane
CID 54383196
(3-Cyclobutyl-2-ethoxy-2-methylpropyl)cyclopentane
CID 57320080
2,2-Di(propan-2-yl)oxepane
CID 58611855
2-Heptyl-2-methyloxolane
CID 66630336

Frequently Asked Questions

What is the IUPAC name of 6-oxaspiro[4.6]undecane?
The IUPAC name of 6-oxaspiro[4.6]undecane (CID 118210180) is 6-oxaspiro[4.6]undecane.
What is the SMILES notation for 6-oxaspiro[4.6]undecane?
The canonical SMILES for 6-oxaspiro[4.6]undecane is C1CCOC2(CC1)CCCC2.
What is the InChIKey of 6-oxaspiro[4.6]undecane?
The InChIKey is DCKQMLNVTUYSHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-2-6-10(11-9-5-1)7-3-4-8-10/h1-9H2.
What are the key properties of 6-oxaspiro[4.6]undecane?
6-oxaspiro[4.6]undecane has a molecular weight of 154.25 g/mol, XLogP of 2.89, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxaspiro[4.6]undecane is sourced from PubChem (CID 118210180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).