8,10-dioxaspiro[4.7]dodecan-11-one

C10H16O3 — CID 167189511

IUPAC8,10-dioxaspiro[4.7]dodecan-11-one
SMILESO=C1CC2(CCCC2)CCOCO1
InChIInChI=1S/C10H16O3/c11-9-7-10(3-1-2-4-10)5-6-12-8-13-9/h1-8H2
InChIKeyXCPABULAOLHBEP-UHFFFAOYSA-N
MW184.23 g/mol
LogP1.86
Rot. Bonds

About 8,10-dioxaspiro[4.7]dodecan-11-one

8,10-dioxaspiro[4.7]dodecan-11-one (PubChem CID 167189511) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is 8,10-dioxaspiro[4.7]dodecan-11-one.

Molecular Properties

Compound Name8,10-dioxaspiro[4.7]dodecan-11-one
PubChem CID167189511
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Name8,10-dioxaspiro[4.7]dodecan-11-one
SMILESO=C1CC2(CCCC2)CCOCO1
InChIInChI=1S/C10H16O3/c11-9-7-10(3-1-2-4-10)5-6-12-8-13-9/h1-8H2
InChIKeyXCPABULAOLHBEP-UHFFFAOYSA-N
XLogP1.86
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.23
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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7-oxaspiro[3.5]nonan-2-one
CID 67451909
spiro[4.6]undecan-10-one
CID 15638085
1,3,5,7-tetraoxecane-8,10-dione
CID 129027461
7-ethenylidene-8-oxaspiro[4.5]decan-9-one
CID 143819117
11-oxaspiro[5.9]pentadecane-8,10,12,14-tetrone
CID 141130807
spiro[2.7]decan-9-one
CID 130028945
2-azoniaspiro[3.5]nonane
CID 28901654
3,3-dimethyl-oxacyclopentadecan-2-one
CID 71147227
1,9-dihydroxy-4,6,12,14,18,20-hexaoxabicyclo[7.7.5]henicosane-3,7,11,15,17,21-hexone
CID 172689316
4,4-diiodooxane
CID 138563806

Frequently Asked Questions

What is the IUPAC name of 8,10-dioxaspiro[4.7]dodecan-11-one?
The IUPAC name of 8,10-dioxaspiro[4.7]dodecan-11-one (CID 167189511) is 8,10-dioxaspiro[4.7]dodecan-11-one.
What is the SMILES notation for 8,10-dioxaspiro[4.7]dodecan-11-one?
The canonical SMILES for 8,10-dioxaspiro[4.7]dodecan-11-one is O=C1CC2(CCCC2)CCOCO1.
What is the InChIKey of 8,10-dioxaspiro[4.7]dodecan-11-one?
The InChIKey is XCPABULAOLHBEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O3/c11-9-7-10(3-1-2-4-10)5-6-12-8-13-9/h1-8H2.
What are the key properties of 8,10-dioxaspiro[4.7]dodecan-11-one?
8,10-dioxaspiro[4.7]dodecan-11-one has a molecular weight of 184.23 g/mol, XLogP of 1.86, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8,10-dioxaspiro[4.7]dodecan-11-one is sourced from PubChem (CID 167189511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).