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CS-W001157 4
Total: USD 88.00

3-Chlorophenyl acetate

  • CAS No. 13031-39-5

  • Cat. No. CS-0111923
  • Purity≥97%
  • MDL No.MFCD00142577

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

3-Chlorophenyl acetate|CS-0111923

Structure of 13031-39-5

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General Information

  • CAS No. 13031-39-5
  • Cat. No. CS-0111923
  • Purity ≥97%
  • MDL No. MFCD00142577
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇ClO₂
  • Molecular Weight 170.59
  • Synonym(s) Acetic acid 3-chlorophenyl ester
  • SMILES O=C(OC1=CC=CC(Cl)=C1)C

Synthesis

  • Route1
    • null|null
      108-43-0
    • null|null
      75-36-5
    • ~91%
    • In-stock
      3-Chlorophenyl acetate|CS-0111923
      13031-39-5

    References

    • Silva, Vera L. M.; Silva, Artur M. S.; Pinto, Diana C. G. A.; Jagerovic, Nadine; Callado, Luis F.; Cavaleiro, Jose A. S.; Elguero, Jose Monatshefte fur Chemie, 2007 , vol. 138, # 8 p. 797 - 811
  • Route2
    • null|null
      108-43-0
    • null|null
      108-24-7
    • ~96%
    • In-stock
      3-Chlorophenyl acetate|CS-0111923
      13031-39-5

    References

    • Roy, Bimalendu; Dasgupta, Somnath; Kumar Rajput, Vishal; Mukhopadhyay, Balaram Journal of Carbohydrate Chemistry, 2008 , vol. 27, # 1 p. 1 - 9
  • Route3
    • null|null
      108-43-0
    • null|null
      7664-93-9
    • ~%
    • In-stock
      3-Chlorophenyl acetate|CS-0111923
      13031-39-5

    References

    • The Boots Company PLC Patent: US5547972 A1, 1996 ;

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   2.2653
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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