Benzonitrile, 4-chloro-3,5-dinitro-


Chemical Name: Benzonitrile, 4-chloro-3,5-dinitro-
CAS Number: 1930-72-9
Product Number: AG003L4K(AGN-PC-0JKCMO)
Synonyms:
MDL No:
Molecular Formula: C7H2ClN3O4
Molecular Weight: 227.56148

Identification/Properties


Properties
MP:
140.5-141 °C(lit.)
Form:
Solid
Refractive Index:
1.6000 (estimate)
Computed Properties
Molecular Weight:
227.56g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
226.973g/mol
Monoisotopic Mass:
226.973g/mol
Topological Polar Surface Area:
115A^2
Heavy Atom Count:
15
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:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


Other Analytical Data


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