2,1,3-Benzoxadiazole, 4-chloro-7-nitro-


Chemical Name: 2,1,3-Benzoxadiazole, 4-chloro-7-nitro-
CAS Number: 10199-89-0
Product Number: AG00066P(AGN-PC-0JKHZI)
Synonyms:
MDL No:
Molecular Formula: C6H2ClN3O3
Molecular Weight: 199.5514

Identification/Properties


Properties
MP:
97-99 °C
BP:
333.144 °C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;Keep in dry area;
Form:
Solid
Refractive Index:
1.5810 (estimate)
Solubility:
Soluble in methanol, dimethylsulfoxide, dimethylformamide and chloroform.
Computed Properties
Molecular Weight:
199.55g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
198.978g/mol
Monoisotopic Mass:
198.978g/mol
Topological Polar Surface Area:
84.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
222
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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