2,4,8-trioxaspiro[6.6]tridecane

C10H18O3 — CID 146474220

IUPAC2,4,8-trioxaspiro[6.6]tridecane
SMILESC1CCOC2(CC1)CCOCOC2
InChIInChI=1S/C10H18O3/c1-2-4-10(13-6-3-1)5-7-11-9-12-8-10/h1-9H2
InChIKeyCYFHFZARCJLXGI-UHFFFAOYSA-N
MW186.25 g/mol
LogP1.71
Rot. Bonds

About 2,4,8-trioxaspiro[6.6]tridecane

2,4,8-trioxaspiro[6.6]tridecane (PubChem CID 146474220) has the molecular formula C10H18O3 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2,4,8-trioxaspiro[6.6]tridecane.

Molecular Properties

Compound Name2,4,8-trioxaspiro[6.6]tridecane
PubChem CID146474220
Molecular FormulaC10H18O3
Molecular Weight186.25 g/mol
Exact Mass186.13
IUPAC Name2,4,8-trioxaspiro[6.6]tridecane
SMILESC1CCOC2(CC1)CCOCOC2
InChIInChI=1S/C10H18O3/c1-2-4-10(13-6-3-1)5-7-11-9-12-8-10/h1-9H2
InChIKeyCYFHFZARCJLXGI-UHFFFAOYSA-N
XLogP1.71
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7,11-dioxaspiro[5.6]dodecane
CID 122692865
1,8-dioxaspiro[2.6]nonane
CID 88652146
1-oxaspiro[2.7]decane
CID 13240757
1,10-dioxa-7-azaspiro[4.6]undecane
CID 118210191
1,3-dioxacycloheptadecane
CID 54126867
5-oxaspiro[3.5]nonan-2-one
CID 171035049
(6S)-1-oxa-8-azaspiro[5.5]undecane
CID 98010276
1,10-dioxa-4-azaspiro[5.6]dodecane
CID 65122138
1-oxa-4-azaspiro[5.6]dodecan-4-yl(5-oxaspiro[2.4]heptan-2-yl)methanone
CID 127875131
methanamine;molecular hydrogen;1-oxaspiro[3.5]nonane
CID 171551994
3,3-dimethyl-oxacyclotetradecane
CID 15424844
4,7-dioxaspiro[2.6]nonane
CID 118210447

Frequently Asked Questions

What is the IUPAC name of 2,4,8-trioxaspiro[6.6]tridecane?
The IUPAC name of 2,4,8-trioxaspiro[6.6]tridecane (CID 146474220) is 2,4,8-trioxaspiro[6.6]tridecane.
What is the SMILES notation for 2,4,8-trioxaspiro[6.6]tridecane?
The canonical SMILES for 2,4,8-trioxaspiro[6.6]tridecane is C1CCOC2(CC1)CCOCOC2.
What is the InChIKey of 2,4,8-trioxaspiro[6.6]tridecane?
The InChIKey is CYFHFZARCJLXGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O3/c1-2-4-10(13-6-3-1)5-7-11-9-12-8-10/h1-9H2.
What are the key properties of 2,4,8-trioxaspiro[6.6]tridecane?
2,4,8-trioxaspiro[6.6]tridecane has a molecular weight of 186.25 g/mol, XLogP of 1.71, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,8-trioxaspiro[6.6]tridecane is sourced from PubChem (CID 146474220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).