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(3-Chloro-5-nitrophenyl)methanol

  • CAS No. 79944-62-0

  • Cat. No. CS-0157685
  • Purity≥98%
  • MDL No.MFCD08236779

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

(3-Chloro-5-nitrophenyl)methanol|CS-0157685

Structure of 79944-62-0

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General Information

  • CAS No. 79944-62-0
  • Cat. No. CS-0157685
  • Purity ≥98%
  • MDL No. MFCD08236779
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆ClNO₃
  • Molecular Weight 187.58
  • Synonym(s) 3-Chloro-5-nitrobenzyl alcohol
  • SMILES C1=C(C=C(C=C1Cl)[N+](=O)[O-])CO

Synthesis

  • Route1

    References

    • NOVARTIS AG; NOVARTIS PHARMA GMBH Patent: WO2007/144127 A1, 2007 ; Location in patent: Page/Page column 38 ; WO 2007/144127 A1
  • Route2

    References

    • BAYER PHARMA AKTIENGESELLSCHAFT; LÜCKING, Ulrich; KOSEMUND, Ulrich; BOHLMANN, Rolf; SCHOLZ, Arne; LIENAU, Philip; SIEMEISTER, Gerhard; BÖMER, Ulf Patent: WO2014/76028 A1, 2014 ; Location in patent: Page/Page column 97 ;
  • Route3
    • null|null
      71022-43-0
    • ~%
    • In-stock
      (3-Chloro-5-nitrophenyl)methanol|CS-0157685
      79944-62-0

    References

    • Campbell, Robert F.; Fitzpatrick, Kevin; Inghardt, Tord; Karlsson, Olle; Nilsson, Kristina; Reilly, John E.; Yet, Larry Tetrahedron Letters, 2003 , vol. 44, # 29 p. 5477 - 5481

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   63.37
  • LogP   1.7405
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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