chempirical

Methylnitronitrosoguanidine

C2H5N5O3CAS 70-25-7147.09 g/mol

Open in Covalent MOL file
NNONHNHN+OO−
GuanidineNitro

Properties

Molecular formula
C2H5N5O3
Molar mass
147.09 g/mol
Exact mass
147.0392 Da
Melting point
118–123.5 °C (decomposes)
logP
-0.68Crippen estimate
Polar surface area
111.7 Ų
H-bond donors / acceptors
2 / 5
Rotatable bonds
2

Identifiers

CAS number
70-25-7
SMILES
CN(N=O)C(=N)N[N+](=O)[O-]
InChIKey
VZUNGTLZRAYYDE-UHFFFAOYSA-N
InChI
InChI=1S/C2H5N5O3/c1-6(5-8)2(3)4-7(9)10/h1H3,(H2,3,4)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

20 names · show all
  • Guanidine, N-methyl-N′-nitro-N-nitroso-
  • Guanidine, 1-methyl-3-nitro-1-nitroso-
  • N-Methyl-N′-nitro-N-nitrosoguanidine
  • 1-Methyl-3-nitro-1-nitrosoguanidine
  • N-Nitroso-N-methyl-N′-nitroguanidine
  • 1-Nitroso-3-nitro-1-methylguanidine
  • N-Methyl-N-nitroso-N′-nitroguanidine
  • MNNG
  • N-Nitroso-N-methylnitroguanidine
  • N-Nitroso-N′-nitro-N-methylguanidine
  • N-Methyl-N1-nitro-N-nitrosoguanidine
  • NSC 9369
  • N-Methyl-N′-nitro-N-nitrosoguanadine
  • 1-Methyl-1-nitroso-3-nitroguanidine
  • Nitrosoguanidine
  • 1-Methyl-1-nitroso-2-nitroguanidine
  • NTG
  • N-Methyl-nitroso-N′-nitroguanidine
  • N-Nitrosoguanidine
  • 1-Methyl-2-nitro-1-nitrosoguanidine

Work with Methylnitronitrosoguanidine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Methyl-N′-nitroguanidine4245-76-541 % similar Nitroguanidine556-88-739 % similar 3,6-Dihydro-3-methyl-N-nitro-2H-1,3,5-oxadiazin-4-amine153719-38-136 % similar 4,5-Dihydro-N-nitro-1H-imidazol-2-amine5465-96-332 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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