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CS-W001157 4
Total: USD 88.00

Ethyl 3-chloro-4-methylbenzoate

  • CAS No. 99500-36-4

  • Cat. No. CS-0193897
  • Purity95+%
  • MDL No.None

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

Ethyl 3-chloro-4-methylbenzoate|CS-0193897

Structure of 99500-36-4

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General Information

  • CAS No. 99500-36-4
  • Cat. No. CS-0193897
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁ClO₂
  • Molecular Weight 198.65
  • Synonym(s) 3-CHLORO-4-METHYLBENZOIC ACID ETHYL ESTER
  • SMILES CCOC(=O)C1=CC(=C(C)C=C1)Cl

Synthesis

  • Route1

    References

    • Fujisawa Pharmaceutical Co., Ltd. Patent: US6348474 B1, 2002 ; Location in patent: Page column 141 ;
  • Route2

    References

    • Asaki, Tetsuo; Sugiyama, Yukiteru; Hamamoto, Taisuke; Higashioka, Masaya; Umehara, Masato; Naito, Haruna; Niwa, Tomoko Bioorganic and Medicinal Chemistry Letters, 2006 , vol. 16, # 5 p. 1421 - 1425

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   2.82512
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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