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CS-W001157 4
Total: USD 88.00

3-Methyl-6-nitrobenzo[d]thiazol-2(3h)-imine

  • CAS No. 99700-95-5

  • Cat. No. CS-0306135
  • Purity≥98%
  • MDL No.None

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

3-Methyl-6-nitrobenzo[d]thiazol-2(3h)-imine|CS-0306135

Structure of 99700-95-5

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General Information

  • CAS No. 99700-95-5
  • Cat. No. CS-0306135
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇N₃O₂S
  • Molecular Weight 209.23
  • Synonym(s) 3-Methyl-6-nitro-3H-benzothiazol-2-ylideneamine
  • SMILES N=C1N(C)C(C=C2)=C(C=C2[N+]([O-])=O)S1

Synthesis

  • Route1
    • In-stock
      6-Nitrobenzo[d]thiazol-2-amine|CS-W022514
      6285-57-0
    • null|null
      77-78-1
    • ~%
    • In-stock
      3-Methyl-6-nitrobenzo[d]thiazol-2(3h)-imine|CS-0306135
      99700-95-5

    References

    • Takahashi; Okada Yakugaku Zasshi, 1951 , vol. 71, p. 423 Chem.Abstr., 1952 , p. 4531
  • Route2
    • 3-Methyl-1,3-benzothiazol-2(3H)-imine|CS-0074559
      14779-16-9
    • ~%
    • In-stock
      3-Methyl-6-nitrobenzo[d]thiazol-2(3h)-imine|CS-0306135
      99700-95-5

    References

    • Hunter; Jones Journal of the Chemical Society, 1930 , p. 2190,2209
  • Route3
    • null|null
      1147550-11-5
    • null|null
      100-15-2
    • ~%
    • In-stock
      3-Methyl-6-nitrobenzo[d]thiazol-2(3h)-imine|CS-0306135
      99700-95-5

    References

    • Takahashi; Okada Yakugaku Zasshi, 1951 , vol. 71, p. 423 Chem.Abstr., 1952 , p. 4531

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   71.92
  • LogP   1.62747
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   1

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