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CS-W001157 4
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1-Methyl-2,3-dinitrobenzene

  • CAS No. 602-01-7

  • Cat. No. CS-0231886
  • Purity≥98%
  • MDL No.None

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

1-Methyl-2,3-dinitrobenzene|CS-0231886

Structure of 602-01-7

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General Information

  • CAS No. 602-01-7
  • Cat. No. CS-0231886
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆N₂O₄
  • Molecular Weight 182.13
  • Synonym(s) Benzene, 1-methyl-2,3-dinitro-
  • SMILES [O-][N+](C1=C(C)C=CC=C1[N+]([O-])=O)=O

Synthesis

  • Route1

    References

    • Piotrovskii, L.B.; Poznyakova, L.N. Journal of Organic Chemistry USSR (English Translation), 1982 , vol. 18, p. 1691 - 1695 Zhurnal Organicheskoi Khimii, 1982 , vol. 18, # 9 p. 1931 - 1935
  • Route2
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      861518-90-3
    • ~%
    • 1-Methyl-2,3-dinitrobenzene|CS-0231886
      602-01-7

    References

    • Journal of the American Chemical Society, , vol. 66, p. 1446 Recueil des Travaux Chimiques des Pays-Bas, , vol. 53, p. 1011,1016, 1025
  • Route3
    • null|null
      88-72-2
    • ~%
    • 1-Methyl-2,3-dinitrobenzene|CS-0231886
      602-01-7

    References

    • US5902910 A1, ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS08,GHS09
Signal Word : Danger
UN#: 3454
Class : 6.1(a)
Packing Group : Ⅱ
Hazard Statements : H301-H301+H311+H331-H311-H331-H341-H350-H361-H373-H410
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   86.28
  • LogP   1.81142
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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