1H-Pyrazole, 3,5-dibromo-4-nitro-


Chemical Name: 1H-Pyrazole, 3,5-dibromo-4-nitro-
CAS Number: 104599-36-2
Product Number: AG003905(AGN-PC-00NNHF)
Synonyms:
MDL No:
Molecular Formula: C3HBr2N3O2
Molecular Weight: 270.8669

Identification/Properties


Computed Properties
Molecular Weight:
270.868g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
270.842g/mol
Monoisotopic Mass:
268.844g/mol
Topological Polar Surface Area:
74.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
149
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

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NMR Spectrum


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