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CS-W001157 4
Total: USD 88.00

(2-Chloro-4-formylphenyl)boronic acid

  • CAS No. 1063712-34-4

  • Cat. No. CS-0029542
  • Purity≥98%
  • MDL No.MFCD18311828

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

(2-Chloro-4-formylphenyl)boronic acid|CS-0029542

Structure of 1063712-34-4

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General Information

  • CAS No. 1063712-34-4
  • Cat. No. CS-0029542
  • Purity ≥98%
  • MDL No. MFCD18311828
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆BClO₃
  • Molecular Weight 184.38
  • Synonym(s) B-(2-Chloro-4-formylphenyl)boronic acid; 2-Chloro-4-formylphenylboronic acid
  • SMILES O=CC1=CC=C(B(O)O)C(Cl)=C1

Synthesis

  • Route1
    • 2-(4-Bromo-3-chlorophenyl)-1,3-dioxolane|CS-0193368
      1063712-33-3
    • ~48%
    • In-stock
      (2-Chloro-4-formylphenyl)boronic acid|CS-0029542
      1063712-34-4

    References

    • Dawson, Marcia I.; Xia, Zebin; Jiang, Tao; Ye, Mao; Fontana, Joseph A.; Farhana, Lulu; Patel, Bhaumik; Li, Ping Xue; Bhuiyan, Mohammad; Pellicciari, Roberto; Macchiarulo, Antonio; Nuti, Roberto; Zhang, Xiao-Kun; Han, Young-Hoon; Tautz, Lutz; Hobbs, Peter D.; Jong, Ling; Waleh, Nahid; Chao, Wan-Ru; Feng, Gen-Sheng; Pang, Yuhong; Su, Ying Journal of Medicinal Chemistry, 2008 , vol. 51, # 18 p. 5650 - 5662

Safety Information

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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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   -0.1677
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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