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CS-W001157 4
Total: USD 88.00

4-(Bromomethyl)phenyl acetate

  • CAS No. 52727-95-4

  • Cat. No. CS-W006918
  • Purity≥98%
  • MDL No.MFCD17013576

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

4-(Bromomethyl)phenyl acetate|CS-W006918

Structure of 52727-95-4

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General Information

  • CAS No. 52727-95-4
  • Cat. No. CS-W006918
  • Purity ≥98%
  • MDL No. MFCD17013576
  • Storage -20°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉BrO₂
  • Molecular Weight 229.07
  • Synonym(s) Phenol, 4-(broMoMethyl)-, acetate
  • SMILES CC(OC1=CC=C(CBr)C=C1)=O

Synthesis

  • Route1

    References

    • Jobron, Laurence; Hindsgaul, Ole Journal of the American Chemical Society, 1999 , vol. 121, # 24 p. 5835 - 5836
  • Route2

    References

    • Nakata, Eiji; Yukimachi, Yoshihiro; Nazumi, Yoshijiro; Uto, Yoshihiro; Maezawa, Hiroshi; Hashimoto, Toshihiro; Okamoto, Yasuko; Hori, Hitoshi Chemical Communications, 2010 , vol. 46, # 20 p. 3526 - 3528
  • Route3
    • 4-Hydroxybenzyl alcohol Bisoprolol Alcohol Impurity|CS-0229718
      623-05-2
    • ~%
    • 4-(Bromomethyl)phenyl acetate|CS-W006918
      52727-95-4

    References

    • Jobron, Laurence; Hindsgaul, Ole Journal of the American Chemical Society, 1999 , vol. 121, # 24 p. 5835 - 5836

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302+H312-H314
Precautionary Statements : P260-P264-P270-P280-P304+P340-P330-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.5068
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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