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CS-W001157 4
Total: USD 88.00

3-Chloro-5-methoxybenzoic acid

  • CAS No. 82477-67-6

  • Cat. No. CS-WAA0107
  • Purity≥98%
  • MDL No.MFCD01317994

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

3-Chloro-5-methoxybenzoic acid|CS-WAA0107

Structure of 82477-67-6

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General Information

  • CAS No. 82477-67-6
  • Cat. No. CS-WAA0107
  • Purity ≥98%
  • MDL No. MFCD01317994
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇ClO₃
  • Molecular Weight 186.59
  • Synonym(s) Benzoicacid,3-chloro-5-Methoxy
  • SMILES COC1=CC(=CC(Cl)=C1)C(O)=O

Synthesis

  • Route1
    • null|null
      124-38-9
    • In-stock
      1,3-Dichloro-5-methoxybenzene|CS-W017384
      33719-74-3
    • ~40%
    • In-stock
      3-Chloro-5-methoxybenzoic acid|CS-WAA0107
      82477-67-6

    References

    • ASTRAZENECA AB Patent: WO2003/101956 A1, 2003 ; Location in patent: Page 55 ; WO 03/101956 A1
  • Route2

    References

    • Inghardt, Tord; Johansson, Anders; Svensson, Arne Patent: US2004/19033 A1, 2004 ; Location in patent: Page/Page column 21 ;
  • Route3
    • In-stock
      3,5-Dichlorobenzoic acid|CS-D1400
      51-36-5
    • null|null
      124-41-4
    • ~95%
    • In-stock
      3-Chloro-5-methoxybenzoic acid|CS-WAA0107
      82477-67-6

    References

    • Liu, Jiwen; Fu, Zice; Wang, Yingcai; Schmitt, Mike; Huang, Alan; Marshall, Derek; Tonn, George; Seitz, Lisa; Sullivan, Tim; Lucy Tang; Collins, Tassie; Medina, Julio Bioorganic and Medicinal Chemistry Letters, 2009 , vol. 19, # 22 p. 6419 - 6423

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   2.0468
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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