chempirical

Dinitolmide

C8H7N3O5CAS 148-01-6225.16 g/mol

Open in Covalent MOL file
NH2ON+OO−N+OO−
Nitro

Properties

Molecular formula
C8H7N3O5
Molar mass
225.16 g/mol
Exact mass
225.0386 Da
Melting point
181 °C
logP
1.69Crippen estimate
Polar surface area
130.4 Ų
H-bond donors / acceptors
2 / 5
Rotatable bonds
3

Identifiers

CAS number
148-01-6
SMILES
Cc1c(C(=N)O)cc([N+](=O)[O-])cc1[N+](=O)[O-]
InChIKey
ZEFNOZRLAWVAQF-UHFFFAOYSA-N
InChI
InChI=1S/C8H7N3O5/c1-4-6(8(9)12)2-5(10(13)14)3-7(4)11(15)16/h2-3H,1H3,(H2,9,12)

Weigh it out

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

Names and synonyms

12 names
  • Benzamide, 2-methyl-3,5-dinitro-
  • o-Toluamide, 3,5-dinitro-
  • 2-Methyl-3,5-dinitrobenzamide
  • 3,5-Dinitro-o-toluamide
  • Zoalene
  • Coccidine A
  • Zoamix
  • Coccidot
  • 3,5-Dinitro-2-methylbenzamide
  • Salcostat
  • Coccidin
  • Dinitrotoluamide

Work with Dinitolmide

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

2-Methyl-3,5-dinitrobenzoic acid28169-46-274 % similar Tnt118-96-763 % similar 4-Nitro-1,2-benzenedicarboxamide13138-53-960 % similar 3,5-Dinitrobenzamide121-81-354 % similar 2-Amino-4,6-dinitrotoluene35572-78-254 % similar 2-Nitrobenzamide610-15-154 % similar 5-Fluoro-2-methyl-3-nitrobenzoic acid850462-64-553 % similar 4-Methyl-3,5-dinitrobenzoic acid16533-71-452 % similar

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

Same formula

Furazolidone67-45-8

Elsewhere

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