Guanidine, (2-methyl-5-nitrophenyl)-, mononitrate


Chemical Name: Guanidine, (2-methyl-5-nitrophenyl)-, mononitrate
CAS Number: 152460-08-7
Product Number: AG003BNS(AGN-PC-0O4CEX)
Synonyms:
MDL No:
Molecular Formula: C8H9N5O5
Molecular Weight: 255.1876

Identification/Properties


Properties
MP:
218-219 °C
BP:
426.7°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
257.206g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
257.076g/mol
Monoisotopic Mass:
257.076g/mol
Topological Polar Surface Area:
176A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
269
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:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


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Chemical Structure



1-(2-Methyl-5-nitrophenyl)guanidine nitrate is a versatile compound widely utilized in chemical synthesis as a key intermediate in the production of organic materials. It plays a crucial role in the pharmaceutical industry, where it is used in the synthesis of various biologically active compounds and pharmaceutical drugs. Additionally, this compound is vital in the development of agrochemicals, dyes, and other specialty chemicals. Its unique chemical properties make it a valuable building block in the creation of complex molecules with diverse applications.