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CS-W001157 4
Total: USD 88.00

(1-(tert-butoxycarbonyl)-6-(methoxycarbonyl)-1H-indol-2-yl)boronic acid

  • CAS No. 848357-46-0

  • Cat. No. CS-0002254
  • Purity≥96%
  • MDL No.MFCD11616319

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

(1-(tert-butoxycarbonyl)-6-(methoxycarbonyl)-1H-indol-2-yl)boronic acid|CS-0002254

Structure of 848357-46-0

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General Information

  • CAS No. 848357-46-0
  • Cat. No. CS-0002254
  • Purity ≥96%
  • MDL No. MFCD11616319
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₈BNO₆
  • Molecular Weight 319.12
  • Synonym(s) 2-borono-1H-indole-1,6-dicarboxylic acid-1-(1,1-dimethylethyl) 6-methyl ester
  • SMILES O=C(OC(C)(C)C)N1C(B(O)O)=CC(C=C2)=C1C=C2C(OC)=O

Synthesis

  • Route1

    References

    • JAPAN TOBACCO INC. Patent: US2011/306599 A1, 2011 ;
  • Route2

    References

    • JAPAN TOBACCO INC. Patent: US2011/306599 A1, 2011 ;
  • Route3

    References

    • JAPAN TOBACCO INC. Patent: US2011/306599 A1, 2011 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   97.99
  • LogP   0.8909
  • H_Acceptors   7
  • H_Donors   2
  • Rotatable_Bonds   2

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