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CS-W001157 4
Total: USD 88.00

4-Methyl-3,5-dinitroaniline

  • CAS No. 19406-51-0

  • Cat. No. CS-0237441
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

4-Methyl-3,5-dinitroaniline|CS-0237441

Structure of 19406-51-0

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General Information

  • CAS No. 19406-51-0
  • Cat. No. CS-0237441
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇N₃O₄
  • Molecular Weight 197.15
  • Synonym(s) 4-Amino-2,6-dinitrotoluene
  • SMILES CC1=C(C=C(C=C1[N+](=O)[O-])N)[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      118-96-7
    • ~75%
    • 4-Methyl-3,5-dinitroaniline|CS-0237441
      19406-51-0

    References

    • Barrows, Susan E.; Cramer, Christopher J.; Truhlar, Donald G.; Elovitz, Michael S.; Weber, Eric J. Environmental Science and Technology, 1996 , vol. 30, # 10 p. 3028 - 3038
  • Route2
    • null|null
      118-96-7
    • ~12%
    • null|null
      35572-78-2
    • 4-Methyl-3,5-dinitroaniline|CS-0237441
      19406-51-0

    References

    • Chemical communications (Cambridge, England), , # 6 p. 580 - 581
  • Route3

    References

    • Zhurnal Organicheskoi Khimii, , vol. 6, # 3 p. 520 - 525,518 - 522

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS08,GHS09
Signal Word : Danger
UN#: 3454
Class : 6.1
Packing Group : Ⅱ
Hazard Statements : H301+H311+H331-H373-H411
Precautionary Statements : P260-P261-P264-P270-P271-P273-P280-P302+P352-P304+P340-P330-P361+P364-P391-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   112.3
  • LogP   1.39362
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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