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CS-W001157 4
Total: USD 88.00

2,5-Dichloro-3-nitrobenzoic acid

  • CAS No. 88-86-8

  • Cat. No. CS-0119810
  • Purity≥98%
  • MDL No.MFCD00014691

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

2,5-Dichloro-3-nitrobenzoic acid|CS-0119810

Structure of 88-86-8

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General Information

  • CAS No. 88-86-8
  • Cat. No. CS-0119810
  • Purity ≥98%
  • MDL No. MFCD00014691
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₃Cl₂NO₄
  • Molecular Weight 236.01
  • Synonym(s) None
  • SMILES O=C(O)C1=CC(Cl)=CC([N+]([O-])=O)=C1Cl

Synthesis

  • Route1

    References

    • EPIZYME, INC.; EISAI CO., LTD.; KUNTZ, Kevin, Wayne; CHESWORTH, Richard; DUNCAN, Kenneth, William; KEILHACK, Heike; WARHOLIC, Natalie; KLAUS, Christine; ZHENG, Wanjun Patent: WO2012/142513 A1, 2012 ; Location in patent: Page/Page column 280 ; WO 2012/142513 A1
  • Route2
    • null|null
      77350-06-2
    • ~88%
    • In-stock
      2,5-Dichloro-3-nitrobenzoic acid|CS-0119810
      88-86-8

    References

    • Amchem Products Inc. Patent: US4252979 A1, 1981 ;
  • Route3
    • null|null
      355133-69-6
    • ~%
    • In-stock
      2,5-Dichloro-3-nitrobenzoic acid|CS-0119810
      88-86-8

    References

    • Journal of the Chemical Society, , p. 2381

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

Quality Control

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Computational Chemistry Data

  • TPSA   80.44
  • LogP   2.5998
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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