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CS-W001157 4
Total: USD 88.00

Methyl 2-(bromomethyl)-3-chlorobenzoate

  • CAS No. 188187-03-3

  • Cat. No. CS-W022791
  • Purity≥98%
  • MDL No.MFCD04114322

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

Methyl 2-(bromomethyl)-3-chlorobenzoate|CS-W022791

Structure of 188187-03-3

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General Information

  • CAS No. 188187-03-3
  • Cat. No. CS-W022791
  • Purity ≥98%
  • MDL No. MFCD04114322
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈BrClO₂
  • Molecular Weight None
  • Synonym(s) 2-(bromomethyl)-3-chloro-Benzoic acid,methyl ester
  • SMILES COC(C1=C(C(=CC=C1)Cl)CBr)=O

Synthesis

  • Route1

    References

    • EISAI RandD MANAGEMENT CO., LTD.; YOSHIDA, Ichiro; OKABE, Tadashi; MATSUMOTO, Yasunobu; WATANABE, Nobuhisa; ONIZAWA, Yuji; OHASHI, Yoshiaki; HARADA, Hitoshi Patent: US2013/65925 A1, 2013 ; Location in patent: Paragraph 0338; 0339 ; US 20130065925 A1
  • Route2
    • In-stock
      3-Chloro-2-methylbenzoic acid|CS-W002261
      7499-08-3
    • null|null
      45514-47-4
    • ~83%
    • In-stock
      Methyl 2-(bromomethyl)-3-chlorobenzoate|CS-W022791
      188187-03-3

    References

    • SmithKline Beecham Corporation Patent: US6353116 B1, 2002 ; Location in patent: Page column 24 ; US 6353116 B1
  • Route3

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 23, # 1 p. 360 - 365

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅱ
Hazard Statements : H314-H335
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   3.0215
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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