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CS-W001157 4
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5-Bromo-2-methoxy-3-nitrobenzoic acid

  • CAS No. 60541-89-1

  • Cat. No. CS-0465959
  • Purity≥98%
  • MDL No.MFCD23701717

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

5-Bromo-2-methoxy-3-nitrobenzoic acid|CS-0465959

Structure of 60541-89-1

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General Information

  • CAS No. 60541-89-1
  • Cat. No. CS-0465959
  • Purity ≥98%
  • MDL No. MFCD23701717
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆BrNO₅
  • Molecular Weight 276.04
  • Synonym(s) Benzoic acid,5-bromo-2-methoxy-3-nitro
  • SMILES COC1=C(C=C(C=C1[N+](=O)[O-])Br)C(=O)O

Synthesis

  • Route1

    References

    • Almstead, Neil G.; Hwang, Peter Seongwoo; Moon, Young-Choon; Welch, Ellen M. Patent: US2008/139632 A1, 2008 ; Location in patent: Page/Page column 19 ;
  • Route2

    References

    • Baruah, Pranjal K.; Sreedevi; Gonnade, Rajesh; Ravindranathan, Sapna; Damodaran, Krishnan; Hofmann, Hans-Joerg; Sanjayan, Gangadhar J. Journal of Organic Chemistry, 2007 , vol. 72, # 2 p. 636 - 639

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+H312+H332-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   89.67
  • LogP   2.0641
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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