1,4-dioxaspiro[4.4]nonane;ethane

C11H24O2 — CID 144903922

IUPAC1,4-dioxaspiro[4.4]nonane;ethane
SMILESC1CCC2(C1)OCCO2.CC.CC
InChIInChI=1S/C7H12O2.2C2H6/c1-2-4-7(3-1)8-5-6-9-7;2*1-2/h1-6H2;2*1-2H3
InChIKeyIDFAAPUJPSLZQW-UHFFFAOYSA-N
MW188.31 g/mol
LogP3.36
Rot. Bonds

About 1,4-dioxaspiro[4.4]nonane;ethane

1,4-dioxaspiro[4.4]nonane;ethane (PubChem CID 144903922) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is 1,4-dioxaspiro[4.4]nonane;ethane.

Molecular Properties

Compound Name1,4-dioxaspiro[4.4]nonane;ethane
PubChem CID144903922
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Name1,4-dioxaspiro[4.4]nonane;ethane
SMILESC1CCC2(C1)OCCO2.CC.CC
InChIInChI=1S/C7H12O2.2C2H6/c1-2-4-7(3-1)8-5-6-9-7;2*1-2/h1-6H2;2*1-2H3
InChIKeyIDFAAPUJPSLZQW-UHFFFAOYSA-N
XLogP3.36
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-dioxaspiro[4.5]decane;ethane
CID 143191896
(12E)-1,4-dioxaspiro[4.15]icos-12-ene
CID 11357975
4,9-dioxaspiro[2.6]nonane
CID 68651979
spiro[1,3-dioxolane-2,8'-bicyclo[14.1.0]heptadecane]
CID 91594454
3,9-diazaspiro[5.5]undecane;1,4-dioxaspiro[4.5]decane
CID 142351057
ethane;8-methyl-1,4-dioxaspiro[4.5]decan-8-ol
CID 143931263
8,11-dioxadispiro[3.2.47.24]tridecane
CID 171769026
8-fluoro-8-propan-2-yl-1,4-dioxaspiro[4.5]decane
CID 155319961
8-methyl-1,4-dioxaspiro[4.5]decan-8-amine
CID 21134196
1,4-dioxadispiro[4.1.57.15]tridecane
CID 177024973
8,8-dimethyl-1,4-dioxa-8-azoniaspiro[4.5]decane iodide
CID 12872418
8-cyclobutylidene-1,4-dioxaspiro[4.5]decane
CID 118423720

Frequently Asked Questions

What is the IUPAC name of 1,4-dioxaspiro[4.4]nonane;ethane?
The IUPAC name of 1,4-dioxaspiro[4.4]nonane;ethane (CID 144903922) is 1,4-dioxaspiro[4.4]nonane;ethane.
What is the SMILES notation for 1,4-dioxaspiro[4.4]nonane;ethane?
The canonical SMILES for 1,4-dioxaspiro[4.4]nonane;ethane is C1CCC2(C1)OCCO2.CC.CC.
What is the InChIKey of 1,4-dioxaspiro[4.4]nonane;ethane?
The InChIKey is IDFAAPUJPSLZQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O2.2C2H6/c1-2-4-7(3-1)8-5-6-9-7;2*1-2/h1-6H2;2*1-2H3.
What are the key properties of 1,4-dioxaspiro[4.4]nonane;ethane?
1,4-dioxaspiro[4.4]nonane;ethane has a molecular weight of 188.31 g/mol, XLogP of 3.36, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dioxaspiro[4.4]nonane;ethane is sourced from PubChem (CID 144903922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).