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CS-W001157 4
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(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanamine hydrochloride

  • CAS No. 850568-55-7

  • Cat. No. CS-0174692
  • Molecule weightNone
  • Purity≥97%
  • MDL No.MFCD02179455

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

(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanamine hydrochloride|CS-0174692

Structure of 850568-55-7

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General Information

  • CAS No. 850568-55-7
  • Cat. No. CS-0174692
  • Purity ≥97%
  • MDL No. MFCD02179455
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₂₁BClNO₂
  • Molecular Weight None
  • Synonym(s) 4-AMINOMETHYLPHENYLBORONIC ACID, PINACOL ESTER, HCL
  • SMILES CC1(C(C)(OB(O1)C2=CC=C(CN)C=C2)C)C.Cl

Synthesis

  • Route1

    References

    • Andersen, Valdemar L.; Herth, Matthias M.; Lehel, Szabolcs; Knudsen, Gitte M.; Kristensen, Jesper L. Tetrahedron Letters, 2013 , vol. 54, # 3 p. 213 - 216
  • Route2

    References

    • Tetrahedron Letters, , vol. 54, # 3 p. 213 - 216

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   44.48
  • LogP   1.8663
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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