Benzonitrile, 2-amino-3-chloro-5-nitro-


Chemical Name: Benzonitrile, 2-amino-3-chloro-5-nitro-
CAS Number: 20352-84-5
Product Number: AG0028Z4(AGN-PC-0JLXH1)
Synonyms:
MDL No: MFCD00126957
Molecular Formula: C7H4ClN3O2
Molecular Weight: 197.5786

Identification/Properties


Properties
MP:
183-187 °C(lit.)
BP:
353.4°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.5557 (estimate)
Computed Properties
Molecular Weight:
197.578g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
196.999g/mol
Monoisotopic Mass:
196.999g/mol
Topological Polar Surface Area:
95.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
256
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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