8,8-diethyl-1,7-dioxaspiro[4.4]nonane

C11H20O2 — CID 135011811

IUPAC8,8-diethyl-1,7-dioxaspiro[4.4]nonane
SMILESCCC1(CC)CC2(CCCO2)CO1
InChIInChI=1S/C11H20O2/c1-3-10(4-2)8-11(9-13-10)6-5-7-12-11/h3-9H2,1-2H3
InChIKeyNWRHZDRJMBCEIK-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.51
Rot. Bonds2

About 8,8-diethyl-1,7-dioxaspiro[4.4]nonane

8,8-diethyl-1,7-dioxaspiro[4.4]nonane (PubChem CID 135011811) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 8,8-diethyl-1,7-dioxaspiro[4.4]nonane.

Molecular Properties

Compound Name8,8-diethyl-1,7-dioxaspiro[4.4]nonane
PubChem CID135011811
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name8,8-diethyl-1,7-dioxaspiro[4.4]nonane
SMILESCCC1(CC)CC2(CCCO2)CO1
InChIInChI=1S/C11H20O2/c1-3-10(4-2)8-11(9-13-10)6-5-7-12-11/h3-9H2,1-2H3
InChIKeyNWRHZDRJMBCEIK-UHFFFAOYSA-N
XLogP2.51
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-Dimethyl-2-(2-methyloxolan-2-yl)oxolane
CID 567170
5-Methyl-2-(2-methyl-2-tetrahydrofuryl)tetrahydrofuran
CID 558958
1,13-Dioxadispiro[4.1.57.25]tetradecane
CID 25053686
2,2-Dibutyl-4-methoxyoxolane
CID 51358010
2,5-Dimethyl-2-(2-tetrahydrofuryl)tetrahydrofuran
CID 567156
2,2,6,6-Tetraethyl-1,7-dioxaspiro[3.4]octane
CID 11241627
8,8-Diethyl-2,2-dimethyl-1,7-dioxaspiro[4.4]nonane
CID 11390222
8,8-Diethyl-2,2-dipentyl-1,7-dioxaspiro[4.4]nonane
CID 12181970
8,8-Diethyl-2-hexyl-1,7-dioxaspiro[4.4]nonane
CID 12181971
2-Methyl-2-(oxolan-2-ylmethyl)oxolane
CID 53681163
2-(Hexoxymethyl)-2-pentadecyloxolane
CID 57180127
3-Methyl-1-(2-methylpropyl)-2,5-dioxabicyclo[2.2.1]heptane
CID 58002929

Frequently Asked Questions

What is the IUPAC name of 8,8-diethyl-1,7-dioxaspiro[4.4]nonane?
The IUPAC name of 8,8-diethyl-1,7-dioxaspiro[4.4]nonane (CID 135011811) is 8,8-diethyl-1,7-dioxaspiro[4.4]nonane.
What is the SMILES notation for 8,8-diethyl-1,7-dioxaspiro[4.4]nonane?
The canonical SMILES for 8,8-diethyl-1,7-dioxaspiro[4.4]nonane is CCC1(CC)CC2(CCCO2)CO1.
What is the InChIKey of 8,8-diethyl-1,7-dioxaspiro[4.4]nonane?
The InChIKey is NWRHZDRJMBCEIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-10(4-2)8-11(9-13-10)6-5-7-12-11/h3-9H2,1-2H3.
What are the key properties of 8,8-diethyl-1,7-dioxaspiro[4.4]nonane?
8,8-diethyl-1,7-dioxaspiro[4.4]nonane has a molecular weight of 184.28 g/mol, XLogP of 2.51, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-diethyl-1,7-dioxaspiro[4.4]nonane is sourced from PubChem (CID 135011811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).