1,4-dioxaspiro[4.5]decane;ethane

C10H20O2 — CID 143191896

IUPAC1,4-dioxaspiro[4.5]decane;ethane
SMILESC1CCC2(CC1)OCCO2.CC
InChIInChI=1S/C8H14O2.C2H6/c1-2-4-8(5-3-1)9-6-7-10-8;1-2/h1-7H2;1-2H3
InChIKeyMUECZJKJMBXGSH-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.72
Rot. Bonds

About 1,4-dioxaspiro[4.5]decane;ethane

1,4-dioxaspiro[4.5]decane;ethane (PubChem CID 143191896) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 1,4-dioxaspiro[4.5]decane;ethane.

Molecular Properties

Compound Name1,4-dioxaspiro[4.5]decane;ethane
PubChem CID143191896
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name1,4-dioxaspiro[4.5]decane;ethane
SMILESC1CCC2(CC1)OCCO2.CC
InChIInChI=1S/C8H14O2.C2H6/c1-2-4-8(5-3-1)9-6-7-10-8;1-2/h1-7H2;1-2H3
InChIKeyMUECZJKJMBXGSH-UHFFFAOYSA-N
XLogP2.72
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-dioxaspiro[4.4]nonane;ethane
CID 144903922
(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
1,4-dioxadispiro[4.1.57.15]tridecane
CID 177024973
ethane;8-methyl-1,4-dioxaspiro[4.5]decan-8-ol
CID 143931263
7-methylidene-1,4-dioxaspiro[4.8]tridecane
CID 10750402
ethyl 8-methyl-1,4-dioxaspiro[4.51]hexapentacontane-8-carboxylate
CID 139462864
9,9-dimethyl-1,5-dioxa-9-azoniaspiro[5.5]undecane
CID 101394183
8,11-dioxadispiro[3.2.47.24]tridecane
CID 171769026
1,4-dioxaspiro[4.5]decane;phenylmethanamine
CID 143618966

Frequently Asked Questions

What is the IUPAC name of 1,4-dioxaspiro[4.5]decane;ethane?
The IUPAC name of 1,4-dioxaspiro[4.5]decane;ethane (CID 143191896) is 1,4-dioxaspiro[4.5]decane;ethane.
What is the SMILES notation for 1,4-dioxaspiro[4.5]decane;ethane?
The canonical SMILES for 1,4-dioxaspiro[4.5]decane;ethane is C1CCC2(CC1)OCCO2.CC.
What is the InChIKey of 1,4-dioxaspiro[4.5]decane;ethane?
The InChIKey is MUECZJKJMBXGSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2.C2H6/c1-2-4-8(5-3-1)9-6-7-10-8;1-2/h1-7H2;1-2H3.
What are the key properties of 1,4-dioxaspiro[4.5]decane;ethane?
1,4-dioxaspiro[4.5]decane;ethane has a molecular weight of 172.27 g/mol, XLogP of 2.72, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dioxaspiro[4.5]decane;ethane is sourced from PubChem (CID 143191896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).