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7-Methoxy-1H-indole-3-carbaldehyde

  • CAS No. 109021-59-2

  • Cat. No. CS-0050010
  • Molecule weight175.18
  • Purity≥97%
  • MDL No.None

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

7-Methoxy-1H-indole-3-carbaldehyde|CS-0050010

Structure of 109021-59-2

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General Information

  • CAS No. 109021-59-2
  • Cat. No. CS-0050010
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉NO₂
  • Molecular Weight 175.18
  • Synonym(s) 7-Methoxy-3-indolecarboxaldehyde
  • SMILES COC1=CC=CC2=C1NC=C2C=O

Synthesis

  • Route1

    References

    • Niewohner, Ulrich; Niewohner, Maria; Bauser, Marcus; Erguden, Jens-Kerim; Flubacher, Dietmar; Naab, Paul; Repp, Thorsten-Oliver; Stoltefuss, Jurgen; Burkhardt, Nils; Sewing, Andrea; Schauer, Michael; Schlemmer, Karl-Heinz; Weber, Olaf; Boyer, Stephen J.; Miglarese, Mark; Fan, Jianmei; Phillips, Barton; Raudenbush, Brian C.; Wang, Yamin Patent: US2003/236276 A1, 2003 ; Location in patent: Page 15 ; US 20030236276 A1
  • Route2

    References

    • Journal of Medicinal Chemistry, , vol. 47, # 25 p. 6270 - 6282
  • Route3

    References

    • Journal of Medicinal Chemistry, , vol. 47, # 25 p. 6270 - 6282

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-H332-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   42.09
  • LogP   1.989
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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