Formula of 2,4-Dinitrofluorobenzene (C6H3FN2O4)

Chemical Formula Description

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Additional Information for Identifying 2,4-Dinitrofluorobenzene Molecule

• Structure Data File (SDF/MOL File) of 2,4-Dinitrofluorobenzene

  The structure data file (SDF/MOL File) of 2,4-Dinitrofluorobenzene is available for download in the SDF page of 2,4-Dinitrofluorobenzene providing the information about the atoms, bonds, connectivity and coordinates of 2,4-Dinitrofluorobenzene, which is not completely available in the chemical formula representation. The 2,4-Dinitrofluorobenzene structure data file can be imported to most of the cheminformatics software for further analysis and visualization.

• Chemical structure of 2,4-Dinitrofluorobenzene

  The chemical structure image of 2,4-Dinitrofluorobenzene is available in chemical structure page of 2,4-Dinitrofluorobenzene, which specifies the molecular geometry, i.e., the spatial arrangement of atoms in the chemical formula of 2,4-Dinitrofluorobenzene and the chemical bonds that hold the atoms together.

• Molecular weight of 2,4-Dinitrofluorobenzene

  The molecular weight of 2,4-Dinitrofluorobenzene is available in molecular weight page of 2,4-Dinitrofluorobenzene, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element specified in the chemical formula of 2,4-Dinitrofluorobenzene.

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• InChI (IUPAC International Chemical Identifier) information of 2,4-Dinitrofluorobenzene

  The molecular chemical formulas lack structural information. An alternative textual expression including the structural information is InChI. The full standard InChI of 2,4-Dinitrofluorobenzene is:

  InChI=1S/C6H3FN2O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H

  It can provide a standard way to encode the molecular information of 2,4-Dinitrofluorobenzene to facilitate the search for the compound information in databases and on the web.
  
  

  The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of 2,4-Dinitrofluorobenzene is:

  InChIKey=LOTKRQAVGJMPNV-UHFFFAOYSA-N

  The InChIKey may allow easier web searches for 2,4-Dinitrofluorobenzene, but it needs to be linked to the full InChI to get back to the original structure of the 2,4-Dinitrofluorobenzene since the full standard InChI cannot be reconstructed from the InChIKey.

• Other names (synonyms) or registry numbers of 2,4-Dinitrofluorobenzene

  The 2,4-Dinitrofluorobenzene compound may have different names depending on the various different situations of industrial applications. The list of the other names (synonyms) of 2,4-Dinitrofluorobenzene including the registry numbers is given below, if available:

  • C-34426
  • EN300-153237
  • BBV-38371965
  • AR-1J0738
  • ZX-AP004769
  • 369-18-6
  • 1-Fluoro-2,4-dinitrobenzene, for HPLC derivatization, >=99.0% (GC)
  • 1-Fluoro-2,4-dinitrobenzene, purum p.a., >=98.0% (GC)
  • F0850-6563
  • 1-Fluoro-2,4-dinitrobenzene, >=99.0% (GC)

  • 1-Fluoro-2,4-dinitrobenzene: Sanger's reagent
  • D0835
  • 1-Fluoro-2,4-dinitrobenzene, 99% 5g
  • 1-Fluoro-2,4-dinitrobenzene, >=99%
  • RTR-032489
  • D241E059U6
  • ANW-35883
  • Benzene,4-dinitro-1-fluoro-
  • 1-fluoro-2,4-dinitrobenzen
  • 2,4-dinitro fluorobenzene

  • 2,4,-dinitrofluorobenzene
  • 2,4-dinitrophenylfluoride
  • 2,4-dinitriofluorobenzene
  • 1,4-Fluorodinitrobenzene
  • 2.4-dinitrofluorobenzene
  • 2,4-dinitroflurobenzene
  • DNPF
  • CAS-70-34-8
  • 2,4-Dinitrofluorobenzene (Sanger's reagent)
  • MFCD00007056

  • 1-fluoro-2,4-dinitro-benzene
  • 1,2,4-Fluorodinitrobenzene
  • Fluorodinitrobenzene (VAN)
  • DFB (VAN)
  • Benzene, 2,4-dinitro-1-fluoro-
  • 2,4-DNFB
  • 2,4-Dinitrobenzene fluoride
  • Benzene, 1-fluoro-2,4-dinitro-
  • Fluorodinitrobenzene
  • 2,4-Dinitrophenyl fluoride

  • 2,4-Dinitrobenzenefluoride
  • Fluoro-2,4-dinitrobenzene
  • Sanger's Reagent
  • 2,4-Dinitro-1-fluorobenzene
  • DNFB
  • Dinitrofluorobenzene
  • FDNB
  • 70-34-8
  • 2,4-Dinitrofluorobenzene

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2,4-Dinitrofluorobenzene Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 2,4-Dinitrofluorobenzene?
C6H3FN2O4
How many atoms and what are they in the 2,4-Dinitrofluorobenzene structure?
16 atom(s) - 3 Hydrogen atom(s), 6 Carbon atom(s), 2 Nitrogen atom(s), 4 Oxygen atom(s), and 1 Fluorine atom(s)
How many chemical bonds and what are they in the 2,4-Dinitrofluorobenzene structure?
16 bond(s) - 13 non-H bond(s), 10 multiple bond(s), 2 rotatable bond(s), 4 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), and 2 nitro group(s) (aromatic)
What’s the molecular weight of 2,4-Dinitrofluorobenzene?
186.09742 g/mol
What’s the SMILES string of 2,4-Dinitrofluorobenzene?
[O-][N+](=O)c1ccc(F)c(c1)[N+]([O-])=O
What’s the InChI of 2,4-Dinitrofluorobenzene?
InChI=1S/C6H3FN2O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H
What’s the InChIKey of 2,4-Dinitrofluorobenzene?
LOTKRQAVGJMPNV-UHFFFAOYSA-N

509 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).