1H-Pyrazole, 4-bromo-3-nitro-


Chemical Name: 1H-Pyrazole, 4-bromo-3-nitro-
CAS Number: 89717-64-6
Product Number: AG0042EI(AGN-PC-0OM6MH)
Synonyms:
MDL No:
Molecular Formula: C3H2BrN3O2
Molecular Weight: 191.9709

Identification/Properties


Properties
MP:
197-198℃
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
191.972g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
190.933g/mol
Monoisotopic Mass:
190.933g/mol
Topological Polar Surface Area:
74.5A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
125
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#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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