Benzene, 1-isocyanato-2-nitro-


Chemical Name: Benzene, 1-isocyanato-2-nitro-
CAS Number: 3320-86-3
Product Number: AG003HSU(AGN-PC-0JLQAP)
Synonyms:
MDL No:
Molecular Formula: C7H4N2O3
Molecular Weight: 164.1183

Identification/Properties


Properties
Storage:
2-8℃;
Computed Properties
Molecular Weight:
164.12g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
164.022g/mol
Monoisotopic Mass:
164.022g/mol
Topological Polar Surface Area:
75.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
217
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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