SDF/Mol File of 2,4-Dinitrofluorobenzene (C6H3FN2O4)

Structure Data File (SDF/MOL File) Description

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Additional Information for Identifying 2,4-Dinitrofluorobenzene Molecule

• Chemical structure of 2,4-Dinitrofluorobenzene

  By visualizing the structure data file (SDF/MOL File) above, 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 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 masses of each constituent element multiplied by the number of atoms of that element.

• Chemical formula of 2,4-Dinitrofluorobenzene

  The chemical formula of 2,4-Dinitrofluorobenzene is given in chemical formula page of 2,4-Dinitrofluorobenzene, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

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

  An alternative way of expressing structural information in text format 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 be named differently depending on the various situations of industrial applications. Other names (synonyms) of 2,4-Dinitrofluorobenzene including the registry numbers are listed 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 2,4-Dinitrofluorobenzene formula?
C6H3FN2O4
How many atoms and what elements are included in the 2,4-Dinitrofluorobenzene molecule?
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 kind of bonds are 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 2,4-Dinitrofluorobenzene’s molar mass?
186.09742 g/mol
What’s the SMILES structure of 2,4-Dinitrofluorobenzene?
[O-][N+](=O)c1ccc(F)c(c1)[N+]([O-])=O
What’s the InChI code 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 format of 2,4-Dinitrofluorobenzene?
LOTKRQAVGJMPNV-UHFFFAOYSA-N

57 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).