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CS-W001157 4
Total: USD 88.00

4-Nitro-N-propan-2-ylbenzenesulfonamide

  • CAS No. 23530-48-5

  • Cat. No. CS-0061044
  • Purity≥97%
  • MDL No.None

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

4-Nitro-N-propan-2-ylbenzenesulfonamide|CS-0061044

Structure of 23530-48-5

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General Information

  • CAS No. 23530-48-5
  • Cat. No. CS-0061044
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂N₂O₄S
  • Molecular Weight 244.27
  • Synonym(s) N-Isopropyl-4-nitrobenzenesulfonamide
  • SMILES CC(C)NS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      75-31-0
    • null|null
      98-74-8
    • ~94%
    • 4-Nitro-N-propan-2-ylbenzenesulfonamide|CS-0061044
      23530-48-5

    References

    • F. HOFFMANN-LA ROCHE AG; FENG, Lichun; HUANG, Mengwei; LIU, Yongfu; WU, Guolong; YAN, Shixiang; YUN, Hongying; ZHOU, Mingwei Patent: WO2012/101068 A1, 2012 ; Location in patent: Page/Page column 62-64 ;
  • Route2

    References

    • Maclean, Derek; Hale, Ron; Chen, Mingying Organic Letters, 2001 , vol. 3, # 19 p. 2977 - 2980

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   89.31
  • LogP   1.2815
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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