(3-cyano-5-nitrophenyl)boronic acid;N,N-dimethylformamide


Chemical Name: (3-cyano-5-nitrophenyl)boronic acid;N,N-dimethylformamide
CAS Number: 957034-47-8
Product Number: AG003SL4(AGN-PC-0713IA)
Synonyms:
MDL No:
Molecular Formula: C24H22B3N7O13
Molecular Weight: 648.9036

Identification/Properties


Properties
Storage:
Keep in dry area;Room Temperature;
Computed Properties
Molecular Weight:
648.906g/mol
Hydrogen Bond Donor Count:
6
Hydrogen Bond Acceptor Count:
16
Rotatable Bond Count:
3
Exact Mass:
649.155g/mol
Monoisotopic Mass:
649.155g/mol
Topological Polar Surface Area:
351A^2
Heavy Atom Count:
47
Formal Charge:
0
Complexity:
303
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:
4
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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