Cas no 10199-85-6 (Benzene,1,3-dichloro-2,4-dinitro-)

Benzene,1,3-dichloro-2,4-dinitro- structure
10199-85-6 structure
Product Name:Benzene,1,3-dichloro-2,4-dinitro-
CAS No:10199-85-6
MF:C6H2Cl2N2O4
MW:236.997079372406
CID:165095
PubChem ID:3014625
Update Time:2025-04-19

Benzene,1,3-dichloro-2,4-dinitro- Chemical and Physical Properties

Names and Identifiers

    • Benzene,1,3-dichloro-2,4-dinitro-
    • 1,3-dichloro-2,4-dinitrobenzene
    • 1-chloro-2,4-dinitrochlorobenzene
    • 1,3-chloro-2,4-dinitrobenzene
    • 1,3-Dichlor-2,4-dinitrobenzol
    • 1,3-Dichlor-2,4-dinitro-benzol
    • 1,3-dichloro-2,4-dinitro-benzene
    • 1,3-dichloro-4,6-dinitrobenzene
    • 2,4-DICHLORO-1,3-DINITROBENZENE
    • AC1MHZWT
    • AG-D-09984
    • CTK4A0537
    • 10199-85-6
    • AKOS022014387
    • DTXSID40144492
    • CPKWWONSNNHLAN-UHFFFAOYSA-N
    • SCHEMBL2145586
    • AM9813
    • Benzene, 1,3-dichloro-2,4-dinitro-
    • Inchi： 1S/C6H2Cl2N2O4/c7-3-1-2-4(9(11)12)5(8)6(3)10(13)14/h1-2H
    • InChI Key： CPKWWONSNNHLAN-UHFFFAOYSA-N
    • SMILES： ClC1C(=CC=C(C=1[N+](=O)[O-])Cl)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 235.93926
  • Monoisotopic Mass: 235.939
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 0
  • Complexity: 251
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.8
  • Topological Polar Surface Area: 91.6A^2

Experimental Properties

  • Density: 1.729
  • Boiling Point: 340.7°C at 760 mmHg
  • Flash Point: 159.8°C
  • Refractive Index: 1.636
  • PSA: 86.28
  • LogP: 3.85620

Benzene,1,3-dichloro-2,4-dinitro- Related Literature

  • 1. Electrophilic aromatic substitution. Part 34. Nitration of 1-chloro-4-nitro-benzene, 1,3-dichloro-2-nitrobenzene, 1,3-dinitrobenzene, 1-chloro-2,4-dinitro-benzene, and 2-chloro-1,3-dinitrobenzene in sulphuric acid and oleum
    Martin W. Melhuish,Roy B. Moodie,Malcolm A. Payne,Kenneth Schofield J. Chem. Soc. Perkin Trans. 2 1988 1637
  • 2. A kinetic study of chlorine-isotopic exchange between lithium chloride and di- and tri-nitro-derivatives of m- and p-dichlorobenzenes
    Peter H. Gore,Stuart D. Hammond,Donald F. C. Morris J. Chem. Soc. Perkin Trans. 2 1973 1883
  • 3. Electrophilic aromatic substitution. Part 35. Chlorination of 1,3-dinitrobenzene, 1-chloro-2,4-dinitrobenzene, and 2,4-dinitrotoluene with nitric acid and hydrogen chloride or chlorine in sulphuric acid or oleum
    Martin W. Melhuish,Roy B. Moodie J. Chem. Soc. Perkin Trans. 2 1989 667
  • 4. Chlorine isotopic exchange between lithium chloride-36 and some compounds containing two non-equivalent exchangeable chlorine atoms
    Caterina Arnone,Giovanni Consiglio,Domenico Spinelli,Peter H. Gore,Apollos O. O. Ikejiani,Donald F. C. Morris,Eric L. Short J. Chem. Soc. Perkin Trans. 2 1983 1725
  • 5. 117. The ullman biaryl synthesis. Part I. Atypical products of syntheses of 2,4-dinitrobiphenyl and related compounds

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