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2,3-Diazabicyclo[2.2.2]oct-2-ene,2,3-dioxide

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Name

2,3-Diazabicyclo[2.2.2]oct-2-ene,2,3-dioxide

EINECS N/A
CAS No. 36479-80-8 Density N/A
PSA N/A LogP N/A
Solubility N/A Melting Point N/A
Formula C6H10N2O2 Boiling Point N/A
Molecular Weight 142.158 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 36479-80-8 (2-oxo-3-aza-2-azoniabicyclo[2.2.2]octan-3-olate) Hazard Symbols N/A
Synonyms

2,3-Diazabicyclo[2.2.2]oct-2-ene-2,3-dioxide;

Article Data 2

2,3-Diazabicyclo[2.2.2]oct-2-ene,2,3-dioxide Specification

The 2,3-Diazabicyclo[2.2.2]oct-2-ene,2,3-dioxide is an organic compound with the formula C6H10N2O2. With the CAS registry number 36479-80-8, the IUPAC name of this chemical is 2-oxido-2-aza-3-azoniabicyclo[2.2.2]octane 3-oxide.

Physical properties about 2,3-Diazabicyclo[2.2.2]oct-2-ene,2,3-dioxide are: (1)#H bond acceptors: 4; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 43.55 Å2.

Preparation: this chemical can be prepared by 2,3-diaza-bicyclo[2.2.2]oct-2-ene. This reaction will need reagent oxone and solvent H2O. The reaction time is 7 days by heating. The yield is about 35%.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-]N1[N+](=O)C2CCC1CC2
(2)InChI: InChI=1/C6H10N2O2/c9-7-5-1-2-6(4-3-5)8(7)10/h5-6H,1-4H2
(3)InChIKey: KQTDJBAPOKEJFF-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C6H10N2O2/c9-7-5-1-2-6(4-3-5)8(7)10/h5-6H,1-4H2
(5)Std. InChIKey: KQTDJBAPOKEJFF-UHFFFAOYSA-N

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