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CS-W001157 4
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2-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide

  • CAS No. 1218791-12-8

  • Cat. No. CS-0175467
  • Purity≥98%
  • MDL No.None

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

2-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide|CS-0175467

Structure of 1218791-12-8

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General Information

  • CAS No. 1218791-12-8
  • Cat. No. CS-0175467
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₇BClNO₃
  • Molecular Weight 281.54
  • Synonym(s) 4-Carbamoyl-3-chlorophenylboronic acid, pinacol ester
  • SMILES CC1(C)C(OB(C2=CC(Cl)=C(C=C2)C(N)=O)O1)(C)C

Synthesis

  • Route1

    References

    • RHIZEN PHARMACEUTICALS SA; INCOZEN THERAPEUTICS PVT. LTD.; VAKKALANKA, Swaroop Kumar Venkata Satya; NAGARATHNAM, Dhanapalan; VISWANADHA, Srikant; MUTHUPPALANIAPPAN, Meyyappan; BABU, Govindarajulu; BHAVAR, Prashant K Patent: WO2013/144737 A2, 2013 ; Location in patent: Paragraph 252 ;

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

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Computational Chemistry Data

  • TPSA   61.55
  • LogP   1.7381
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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