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CS-W001157 4
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2-(5-Chloro-2-methyl-1H-indol-3-yl)acetic acid

  • CAS No. 19017-52-8

  • Cat. No. CS-0103210
  • Purity≥97%
  • MDL No.MFCD00152035

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

2-(5-Chloro-2-methyl-1H-indol-3-yl)acetic acid|CS-0103210

Structure of 19017-52-8

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General Information

  • CAS No. 19017-52-8
  • Cat. No. CS-0103210
  • Purity ≥97%
  • MDL No. MFCD00152035
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₀ClNO₂
  • Molecular Weight 223.66
  • Synonym(s) (5-Chloro-2-methyl-1H-indol-3-yl)-acetic acid
  • SMILES O=C(O)CC1=C(C)NC2=C1C=C(Cl)C=C2

Synthesis

  • Route1
    • Methyl 2-(5-Chloro-2-methyl-1H-indol-3-yl)acetate|CS-0767782
      172595-66-3
    • ~86%
    • In-stock
      2-(5-Chloro-2-methyl-1H-indol-3-yl)acetic acid|CS-0103210
      19017-52-8

    References

    • Kaila, Neelu; Huang, Adrian; Moretto, Alessandro; Follows, Bruce; Janz, Kristin; Lowe, Michael; Thomason, Jennifer; Mansour, Tarek S.; Hubeau, Cedric; Page, Karen; Morgan, Paul; Fish, Susan; Xu, Xin; Williams, Cara; Saiah, Eddine Journal of Medicinal Chemistry, 2012 , vol. 55, # 11 p. 5088 - 5109
  • Route2

    References

    • Journal of Medicinal Chemistry, , vol. 42, # 4 p. 638 - 648
  • Route3
    • Ethyl 2-(5-chloro-2-methyl-1H-indol-3-yl)acetate|CS-0197168
      3446-72-8
    • ~%
    • In-stock
      2-(5-Chloro-2-methyl-1H-indol-3-yl)acetic acid|CS-0103210
      19017-52-8

    References

    • Journal of Medicinal Chemistry, , vol. 42, # 4 p. 638 - 648

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

Quality Control

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Computational Chemistry Data

  • TPSA   53.09
  • LogP   2.75682
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   2

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