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CS-W001157 4
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5-Chloro-7-methyl-1H-indole-2-carboxylic acid

  • CAS No. 15936-74-0

  • Cat. No. CS-0040648
  • Purity≥98%
  • MDL No.MFCD06737780

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

5-Chloro-7-methyl-1H-indole-2-carboxylic acid|CS-0040648

Structure of 15936-74-0

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General Information

  • CAS No. 15936-74-0
  • Cat. No. CS-0040648
  • Purity ≥98%
  • MDL No. MFCD06737780
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈ClNO₂
  • Molecular Weight 209.63
  • Synonym(s) 5-Chlor-7-methyl-hydrindon-(1)
  • SMILES O=C(C(N1)=CC2=C1C(C)=CC(Cl)=C2)O

Synthesis

  • Route1

    References

    • Engelhardt, Harald; De Esch, Iwan J.P.; Kuhn, Daniel; Smits, Rogier A.; Zuiderveld, Obbe P.; Dobler, Julia; Mayer, Moriz; Lips, Sebastian; Arnhof, Heribert; Scharn, Dirk; Haaksma, Eric E.J.; Leurs, Rob European Journal of Medicinal Chemistry, 2012 , vol. 54, p. 660 - 668
  • Route2

    References

    • Engelhardt, Harald; De Esch, Iwan J.P.; Kuhn, Daniel; Smits, Rogier A.; Zuiderveld, Obbe P.; Dobler, Julia; Mayer, Moriz; Lips, Sebastian; Arnhof, Heribert; Scharn, Dirk; Haaksma, Eric E.J.; Leurs, Rob European Journal of Medicinal Chemistry, 2012 , vol. 54, p. 660 - 668

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   53.09
  • LogP   2.82792
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   1

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