7,11-dioxaspiro[5.6]dodecane

C10H18O2 — CID 122692865

IUPAC7,11-dioxaspiro[5.6]dodecane
SMILESC1CCC2(CC1)COCCCO2
InChIInChI=1S/C10H18O2/c1-2-5-10(6-3-1)9-11-7-4-8-12-10/h1-9H2
InChIKeyZIPKIGSCFWMXSY-UHFFFAOYSA-N
MW170.25 g/mol
LogP2.13
Rot. Bonds

About 7,11-dioxaspiro[5.6]dodecane

7,11-dioxaspiro[5.6]dodecane (PubChem CID 122692865) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 7,11-dioxaspiro[5.6]dodecane.

Molecular Properties

Compound Name7,11-dioxaspiro[5.6]dodecane
PubChem CID122692865
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name7,11-dioxaspiro[5.6]dodecane
SMILESC1CCC2(CC1)COCCCO2
InChIInChI=1S/C10H18O2/c1-2-5-10(6-3-1)9-11-7-4-8-12-10/h1-9H2
InChIKeyZIPKIGSCFWMXSY-UHFFFAOYSA-N
XLogP2.13
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,8-dioxaspiro[2.6]nonane
CID 88652146
2,4,8-trioxaspiro[6.6]tridecane
CID 146474220
1-oxaspiro[2.7]decane
CID 13240757
1,10-dioxa-7-azaspiro[4.6]undecane
CID 118210191
methanamine;molecular hydrogen;1-oxaspiro[3.5]nonane
CID 171551994
3,3-dimethyl-oxacyclotetradecane
CID 15424844
(5R,7S)-4,8-dioxadispiro[4.1.47.35]tetradecane
CID 101092010
1,10-dioxa-6-thiaspiro[3.7]undecane
CID 118210217
2,5-dioxa-8-thiaspiro[3.7]undecane
CID 118210763
5-oxaspiro[3.5]nonan-2-one
CID 171035049
2,6,10,13,17-pentaoxadispiro[3.3.38.74]octadecane
CID 71344408
methanol;4-oxaspiro[2.4]heptane
CID 144744375

Frequently Asked Questions

What is the IUPAC name of 7,11-dioxaspiro[5.6]dodecane?
The IUPAC name of 7,11-dioxaspiro[5.6]dodecane (CID 122692865) is 7,11-dioxaspiro[5.6]dodecane.
What is the SMILES notation for 7,11-dioxaspiro[5.6]dodecane?
The canonical SMILES for 7,11-dioxaspiro[5.6]dodecane is C1CCC2(CC1)COCCCO2.
What is the InChIKey of 7,11-dioxaspiro[5.6]dodecane?
The InChIKey is ZIPKIGSCFWMXSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-2-5-10(6-3-1)9-11-7-4-8-12-10/h1-9H2.
What are the key properties of 7,11-dioxaspiro[5.6]dodecane?
7,11-dioxaspiro[5.6]dodecane has a molecular weight of 170.25 g/mol, XLogP of 2.13, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,11-dioxaspiro[5.6]dodecane is sourced from PubChem (CID 122692865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).