Chemical Properties of 2,3-Diazabicyclo[2.2.2]octa-2,5-diene N-oxide (CAS 37436-17-2)

2,3-Diazabicyclo[2.2.2]octa-2,5-diene N-oxide

InChI
InChI=1S/C6H8N2O/c9-8-6-3-1-5(7-8)2-4-6/h1,3,5-6H,2,4H2
InChI Key
REZPTDSIISBQTI-UHFFFAOYSA-N
Formula
C6H8N2O
SMILES
[O-][N+]1=NC2C=CC1CC2
Molecular Weight1
124.14
CAS
37436-17-2
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Physical Properties

Property Value Unit Source
ω 0.3122 Relay (1.0) Calculated Property
ΔfG° 297.86 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 221.00 ± 2.10 kJ/mol NIST
ΔvapH° 64.42 kJ/mol Relay (1.0) Calculated Property
IE 8.83 eV Relay (1.0) Calculated Property
log10WS -0.83 Relay (1.0) Calculated Property
logPoct/wat 1.050 Crippen Calculated Property
McVol 90.910 ml/mol McGowan Calculated Property
Pc 4774.16 kPa Relay (1.0-beta) Calculated Property
Tboil 490.57 K Relay (1.0) Calculated Property
Tc 759.42 K Relay (1.0) Calculated Property
Tfus 415.64 K Relay (1.0) Calculated Property
Vc 0.309 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Erythromycin, ethyl carbonate. guanosine-2'(3')-monophosphate, TMS. (1'S,3R,4a'S,5a'S,10a'S)-Methyl 1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate. Cytidine, metho-oxime-TMS derivative. Mucronatinine. Cytidine, etho-oxime-TMS derivative. Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-. 2'-Deoxyguanosine, N-trimethylsilyl-, tris(trimethylsilyl) ether. Axillarine. guanosine, TMS. Bicyclohexyl-1,1'-diol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. N6-(cyclotetramethylene-tertbutylsilyl)-2'-Deoxyadenosine, 3',5'-bis-O-TBDMS. Nalmefene, bis(trifluoroacetate). Pumiline A. Tetrabenazine M (desmethyl-HO-), monoacetylated.

Find more compounds similar to 2,3-Diazabicyclo[2.2.2]octa-2,5-diene N-oxide.

Sources

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