chempirical

2,4,5,7-Tetranitro-9-fluorenone

C13H4N4O9CAS 746-53-2360.19 g/mol

Open in Covalent MOL file
ON+OO−N+OO−N+OO−N+OO−
KetoneNitro

Properties

Molecular formula
C13H4N4O9
Molar mass
360.19 g/mol
Exact mass
359.9978 Da
logP
2.53Crippen estimate
Polar surface area
189.6 Ų
H-bond donors / acceptors
0 / 9
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
746-53-2
SMILES
C1=C(C=C(C2=C1C(=O)C3=C2C(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
InChIKey
JOERSAVCLPYNIZ-UHFFFAOYSA-N
InChI
InChI=1S/C13H4N4O9/c18-13-7-1-5(14(19)20)3-9(16(23)24)11(7)12-8(13)2-6(15(21)22)4-10(12)17(25)26/h1-4H

Weigh it out

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

Names and synonyms

14 names · show all
  • 2,4,5,7-Tetranitrofluoren-9-one
  • 9H-Fluoren-9-one, 2,4,5,7-tetranitro-
  • 2,4,5,7-Tetranitrofluorenone
  • 2,4,5,7-Tetranitro-9H-fluoren-9-one
  • Tetranitrofluorenone
  • 9H-Fluoren-9-one, tetranitro-
  • Fluoren-9-one, 2,4,5,7-tetranitro-
  • 9H-Fluoren-9-one,2,4,5,7-tetranitro-
  • 2,5,7-Tetranitrofluorenone
  • 2,5,7-Tetranitro-9-fluorenone
  • 2,5,7-Tetranitrofluoren-9-one
  • 2,4,5,7-Tetranitro-9-fluorenon
  • Fluoren-9-one,4,5,7-tetranitro-
  • 9H-Fluoren-9-one,4,5,7-tetranitro-

Reactions

Work with 2,4,5,7-Tetranitro-9-fluorenone

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

Trinitrofluorenone129-79-375 % similar 2,7-Dinitro-9-fluorenone31551-45-857 % similar 2,4,6-Trinitrobenzoic acid129-66-853 % similar 3,5-Dinitrosalicylic acid609-99-453 % similar 1,3,6,8-Tetranitronaphthalene28995-89-352 % similar 2-Bromo-3,5-dinitrobenzoic acid116529-60-351 % similar 2-Chloro-3,5-dinitrobenzoic acid2497-91-851 % similar 2-Methyl-3,5-dinitrobenzoic acid28169-46-251 % similar

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

Elsewhere

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