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2-(2-Aminobenzo[d]thiazol-6-yl)acetonitrile

  • CAS No. 352530-05-3

  • Cat. No. CS-0210694
  • Purity95+%
  • MDL No.MFCD11844845

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

2-(2-Aminobenzo[d]thiazol-6-yl)acetonitrile|CS-0210694

Structure of 352530-05-3

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General Information

  • CAS No. 352530-05-3
  • Cat. No. CS-0210694
  • Purity 95+%
  • MDL No. MFCD11844845
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇N₃S
  • Molecular Weight 189.24
  • Synonym(s) 6-Benzothiazoleacetonitrile,2-amino-(9CI)
  • SMILES N#CCC1=CC=C2N=C(N)SC2=C1

Synthesis

  • Route1

    References

    • Liu, Chunjian; Lin, James; Pitt, Sidney; Zhang, Rosemary F.; Sack, John S.; Kiefer, Susan E.; Kish, Kevin; Doweyko, Arthur M.; Zhang, Hongjian; Marathe, Punit H.; Trzaskos, James; Mckinnon, Murray; Dodd, John H.; Barrish, Joel C.; Schieven, Gary L.; Leftheris, Katerina Bioorganic and Medicinal Chemistry Letters, 2008 , vol. 18, # 6 p. 1874 - 1879
  • Route2

    References

    • BASF Aktiengesellschaft Ludwigshafen, Germany Patent: US2003/153568 A1, 2003 ;

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

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Computational Chemistry Data

  • TPSA   62.7
  • LogP   1.94458
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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