2,3-Butanedione, dioxime


Chemical Name: 2,3-Butanedione, dioxime
CAS Number: 95-45-4
Product Number: AG003PNB(AGN-PC-0OO45T)
Synonyms:
MDL No:
Molecular Formula: C4H8N2O2
Molecular Weight: 116.1185

Identification/Properties


Properties
MP:
240-241 °C(lit.);
BP:
271.5°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.4880 (estimate)
Solubility:
Soluble in alcohol, acetone, ether
Computed Properties
Molecular Weight:
116.12g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
116.059g/mol
Monoisotopic Mass:
116.059g/mol
Topological Polar Surface Area:
65.2A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
112
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
1325
Hazard Statements:
H228
Precautionary Statements:
P210-P240-P241-P280-P370+P378
Class:
4.1
Packing Group:

NMR Spectrum


Other Analytical Data


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