9,10-dioxatricyclo[4.3.1.03,8]decane

C8H12O2 — CID 54547886

IUPAC9,10-dioxatricyclo[4.3.1.03,8]decane
SMILESC1CC2CC3OC1CC2O3
InChIInChI=1S/C8H12O2/c1-2-6-4-7-5(1)3-8(9-6)10-7/h5-8H,1-4H2
InChIKeyZHVJJXJRGRZNNW-UHFFFAOYSA-N
MW140.18 g/mol
LogP1.30
Rot. Bonds

About 9,10-dioxatricyclo[4.3.1.03,8]decane

9,10-dioxatricyclo[4.3.1.03,8]decane (PubChem CID 54547886) has the molecular formula C8H12O2 and a molecular weight of 140.18 g/mol. Its IUPAC name is 9,10-dioxatricyclo[4.3.1.03,8]decane.

Molecular Properties

Compound Name9,10-dioxatricyclo[4.3.1.03,8]decane
PubChem CID54547886
Molecular FormulaC8H12O2
Molecular Weight140.18 g/mol
Exact Mass140.08
IUPAC Name9,10-dioxatricyclo[4.3.1.03,8]decane
SMILESC1CC2CC3OC1CC2O3
InChIInChI=1S/C8H12O2/c1-2-6-4-7-5(1)3-8(9-6)10-7/h5-8H,1-4H2
InChIKeyZHVJJXJRGRZNNW-UHFFFAOYSA-N
XLogP1.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.18
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9,10-dioxatricyclo[4.3.1.03,8]decane?
The IUPAC name of 9,10-dioxatricyclo[4.3.1.03,8]decane (CID 54547886) is 9,10-dioxatricyclo[4.3.1.03,8]decane.
What is the SMILES notation for 9,10-dioxatricyclo[4.3.1.03,8]decane?
The canonical SMILES for 9,10-dioxatricyclo[4.3.1.03,8]decane is C1CC2CC3OC1CC2O3.
What is the InChIKey of 9,10-dioxatricyclo[4.3.1.03,8]decane?
The InChIKey is ZHVJJXJRGRZNNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O2/c1-2-6-4-7-5(1)3-8(9-6)10-7/h5-8H,1-4H2.
What are the key properties of 9,10-dioxatricyclo[4.3.1.03,8]decane?
9,10-dioxatricyclo[4.3.1.03,8]decane has a molecular weight of 140.18 g/mol, XLogP of 1.30, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dioxatricyclo[4.3.1.03,8]decane is sourced from PubChem (CID 54547886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).