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CS-W001157 4
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2-Amino-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

  • CAS No. 760990-10-1

  • Cat. No. CS-0088570
  • Purity≥95%
  • MDL No.MFCD13176535

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

2-Amino-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol|CS-0088570

Structure of 760990-10-1

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General Information

  • CAS No. 760990-10-1
  • Cat. No. CS-0088570
  • Purity ≥95%
  • MDL No. MFCD13176535
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₈BNO₃
  • Molecular Weight 235.09
  • Synonym(s) 3-Amino-4-hydroxyphenylboronic acid pinacol ester
  • SMILES CC(O1)(C)C(C)(C)OB1C2=CC(N)=C(O)C=C2

Synthesis

  • Route1

    References

    • ABBOTT LABORATORIES Patent: WO2004/80973 A1, 2004 ; Location in patent: Page 68 ; WO 2004/080973 A1
  • Route2
    • 2-(4-(Benzyloxy)-3-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane|CS-0971827
      855738-76-0
    • ~84%
    • 2-Amino-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol|CS-0088570
      760990-10-1

    References

    • Shimizu, Kazuki; Maruyama, Minako; Yasui, Yuka; Minegishi, Hidemitsu; Ban, Hyun Seung; Nakamura, Hiroyuki Bioorganic and Medicinal Chemistry Letters, 2010 , vol. 20, # 4 p. 1453 - 1456

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   64.71
  • LogP   1.2736
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   1

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