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CS-W001157 4
Total: USD 88.00

Ethyl 3-bromo-4-methylbenzoate

  • CAS No. 147962-81-0

  • Cat. No. CS-0151794
  • Molecule weight243.10
  • Purity≥98%
  • MDL No.None

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

Ethyl 3-bromo-4-methylbenzoate|CS-0151794

Structure of 147962-81-0

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General Information

  • CAS No. 147962-81-0
  • Cat. No. CS-0151794
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁BrO₂
  • Molecular Weight 243.10
  • Synonym(s) Ethyl3-bromo-4-methylbenzoate
  • SMILES CCOC(=O)C1=CC(=C(C)C=C1)Br

Synthesis

  • Route1
    • In-stock
      3-Bromo-4-methylbenzoic acid|CS-W007779
      7697-26-9
    • null|null
      75-03-6
    • ~78%
    • In-stock
      Ethyl 3-bromo-4-methylbenzoate|CS-0151794
      147962-81-0

    References

    • Kubota, Katsumi; Kurebayashi, Hirotaka; Miyachi, Hirotaka; Tobe, Masanori; Onishi, Masako; Isobe, Yoshiaki Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 9 p. 3005 - 3021
  • Route2

    References

    • Nippon Shinyaku Co., Ltd. Patent: EP1533304 A1, 2005 ; Location in patent: Page/Page column 13 ; EP 1533304 A1
  • Route3

    References

    • Gilbert, Adam M.; Katz, Thomas J.; Geiger, William E.; Robben, Matthew P.; Rheingold, Arnold L. Journal of the American Chemical Society, 1993 , vol. 115, # 8 p. 3199 - 3211

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-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   26.3
  • LogP   2.93422
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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