(2-chloro-5-nitrophenyl)boronic acid


Chemical Name: (2-chloro-5-nitrophenyl)boronic acid
CAS Number: 867333-29-7
Product Number: AG004K8N(AGN-PC-04TKQZ)
Synonyms:
MDL No: MFCD03095323
Molecular Formula: C6H5BClNO4
Molecular Weight: 201.3722

Identification/Properties


Properties
MP:
236-238 °C
BP:
392.9°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
201.369g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
201g/mol
Monoisotopic Mass:
201g/mol
Topological Polar Surface Area:
86.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
198
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


NMR Spectrum


Other Analytical Data


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