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CS-W001157 4
Total: USD 88.00

2-Amino-5-bromo-3-nitrobenzoic acid

  • CAS No. 58580-07-7

  • Cat. No. CS-0145425
  • Purity95+%
  • MDL No.MFCD09970266

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

2-Amino-5-bromo-3-nitrobenzoic acid|CS-0145425

Structure of 58580-07-7

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General Information

  • CAS No. 58580-07-7
  • Cat. No. CS-0145425
  • Purity 95+%
  • MDL No. MFCD09970266
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅BrN₂O₄
  • Molecular Weight 261.03
  • Synonym(s) 2-amino-5-bromo-3-nitrobenzoicaci
  • SMILES O=C(O)C1=CC(Br)=CC([N+]([O-])=O)=C1N

Synthesis

  • Route1

    References

    • MERCK SERONO S.A.; THUNUGUNTLA, Siva Sanjeeva Rao; SUBRAMANYA, Hosahalli; KUNNAM, Satish Reddy; SANIVARU VIJAY, Sekhar Reddy; BINGI, Chakrapani; KUSANUR, Raviraj; SCHWARZ, Matthias; ARLT, Michael Patent: WO2010/115736 A2, 2010 ; Location in patent: Page/Page column 73 ; WO 2010/115736 A2
  • Route2

    References

    • English et al. Journal of the American Chemical Society, 1945 , vol. 67, p. 295,301, 2265
  • Route3

    References

    • Barkalow, Jufang H.; Breting, Jeffrey; Gaede, Bruce J.; Haight, Anthony R.; Henry, Rodger; Kotecki, Brian; Mei, Jianzhang; Pearl, Kurt B.; Tedrow, Jason S.; Viswanath, Shekhar K. Organic Process Research and Development, 2007 , vol. 11, # 4 p. 693 - 698

Safety Information

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

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Computational Chemistry Data

  • TPSA   106.46
  • LogP   1.6377
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   2

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