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CS-W001157 4
Total: USD 88.00

4-Methyl-5-nitrobenzene-1,3-diamine

  • CAS No. 6629-29-4

  • Cat. No. CS-0153544
  • Purity≥98%
  • MDL No.MFCD00088477

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

4-Methyl-5-nitrobenzene-1,3-diamine|CS-0153544

Structure of 6629-29-4

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General Information

  • CAS No. 6629-29-4
  • Cat. No. CS-0153544
  • Purity ≥98%
  • MDL No. MFCD00088477
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉N₃O₂
  • Molecular Weight 167.17
  • Synonym(s) 2,4-Diamino-6-nitrotoluene
  • SMILES CC1=C(C=C(C=C1[N+](=O)[O-])N)N

Synthesis

  • Route1
    • null|null
      118-96-7
    • ~28%
    • null|null
      35572-78-2
    • 4-Methyl-3,5-dinitroaniline|CS-0237441
      19406-51-0
    • 2-Methyl-5-nitrobenzene-1,3-diamine|CS-0699732
      59229-75-3
    • 4-Methyl-5-nitrobenzene-1,3-diamine|CS-0153544
      6629-29-4

    References

    • Kroeger, Mario; Fels, Gregor Journal of Labelled Compounds and Radiopharmaceuticals, 2002 , vol. 45, # 3 p. 249 - 255
  • Route2
    • null|null
      118-96-7
    • ~%
    • 4-Methyl-5-nitrobenzene-1,3-diamine|CS-0153544
      6629-29-4
    • null|null
      88-02-8

    References

    • Chuntiag, Wu; Dorokhov; Boiko; Bal'zhinimaev; Barelko Doklady Chemistry, 2005 , vol. 402, # 4-6 p. 111 - 113
  • Route3
    • null|null
      118-96-7
    • ~%
    • 4-Methyl-5-nitrobenzene-1,3-diamine|CS-0153544
      6629-29-4

    References

    • Tiemann Chemische Berichte, 1870 , vol. 3, p. 218

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   95.18
  • LogP   1.06762
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   1

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