Cas no 3606-21-1 (1-methoxy-5-methyl-2,4-dinitro-Benzene)

1-methoxy-5-methyl-2,4-dinitro-Benzene structure
3606-21-1 structure
Product Name:1-methoxy-5-methyl-2,4-dinitro-Benzene
CAS No:3606-21-1
MF:C8H8N2O5
MW:212.15952205658
CID:309766
PubChem ID:77156
Update Time:2025-04-19

1-methoxy-5-methyl-2,4-dinitro-Benzene Chemical and Physical Properties

Names and Identifiers

    • Benzene,1-methoxy-5-methyl-2,4-dinitro-
    • 1-methoxy-5-methyl-2,4-dinitrobenzene
    • 2,4-Dinitro-5-methoxy-toluol
    • 4,6-Dinitro-3-methoxytoluene
    • 4,6-dinitro-3-methylanisole
    • 4.6-Dinitro-3-methoxy-toluol
    • 5-methoxy-2,4-dinitrotoluene
    • 5-Methyl-2,4-dinitro-anisol
    • 5-methyl-2,4-dinitro-anisole
    • 5-Methyl-2,4-dinitroanisole
    • AC1L2SH0
    • AC1Q1YBG
    • Anisole, 5-methyl-2,4-dinitro-
    • AR-1F8728
    • CTK4H5827
    • EINECS 222-769-3
    • Methyl-(4.6-dinitro-3-methyl-phenyl)-aether
    • NSC403842
    • AI3-00548
    • 3606-21-1
    • NS00029974
    • NSC-403842
    • SCHEMBL2944676
    • NSC 403842
    • DTXSID5063100
    • Benzene, 1-methoxy-5-methyl-2,4-dinitro-
    • 1-methoxy-5-methyl-2,4-dinitro-Benzene
    • Inchi： 1S/C8H8N2O5/c1-5-3-8(15-2)7(10(13)14)4-6(5)9(11)12/h3-4H,1-2H3
    • InChI Key： XLPFUGPSJUAQSY-UHFFFAOYSA-N
    • SMILES： O(C)C1=CC(C)=C(C=C1[N+](=O)[O-])[N+](=O)[O-]

Computed Properties

  • Exact Mass: 212.04334
  • Monoisotopic Mass: 212.043321
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 259
  • 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
  • Topological Polar Surface Area: 101
  • XLogP3: 1.9

Experimental Properties

  • Density: 1.383
  • Boiling Point: 374.7°C at 760 mmHg
  • Flash Point: 186.7°C
  • Refractive Index: 1.577
  • PSA: 95.51
  • LogP: 2.86640

1-methoxy-5-methyl-2,4-dinitro-Benzene Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Methanesulfonic acid ,  Nitrogen dioxide Solvents: Hexane
1.2 Reagents: Oxygen ,  Ozone
1.3 Reagents: Water
Reference
Non-acid synthesis of nitro musks based on the ozone-mediated nitration using nitrogen dioxide
Suzuki, Hitomi; et al, Synthesis, 1999, (8), 1291-1293

1-methoxy-5-methyl-2,4-dinitro-Benzene Raw materials

1-methoxy-5-methyl-2,4-dinitro-Benzene Preparation Products

1-methoxy-5-methyl-2,4-dinitro-Benzene Related Literature

3606-21-1 (1-methoxy-5-methyl-2,4-dinitro-Benzene) Related Products

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