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CS-W001157 4
Total: USD 88.00

1-(4-Methylbenzyl)-1H-indole-3-carbaldehyde

  • CAS No. 151409-79-9

  • Cat. No. CS-0198948
  • Molecule weight249.31
  • Purity≥98%
  • MDL No.None

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

1-(4-Methylbenzyl)-1H-indole-3-carbaldehyde|CS-0198948

Structure of 151409-79-9

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General Information

  • CAS No. 151409-79-9
  • Cat. No. CS-0198948
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₁₅NO
  • Molecular Weight 249.31
  • Synonym(s) 1-[(4-METHYLPHENYL)METHYL]-1H-INDOLE-3-CARBOXALDEHYDE
  • SMILES CC1=CC=C(C=C1)CN2C=C(C=O)C3=CC=CC=C32

Synthesis

  • Route1

    References

    • Guengoer, Timur; Malabre, Patrice; Teulon, Jean-Marie; Camborde, Francoise; Meignen, Joelle; et al. Journal of Medicinal Chemistry, 1994 , vol. 37, # 25 p. 4307 - 4316
  • Route2

    References

    • Reddy, Y. Thirupathi; Sekhar, Konjeti R.; Sasi, Nidhish; Reddy, P. Narsimha; Freeman, Michael L.; Crooks, Peter A. Bioorganic and Medicinal Chemistry Letters, 2010 , vol. 20, # 2 p. 600 - 602
  • Route3

    References

    • Xu, Qinyuan; Huang, Li; Liu, Juan; Ma, Liang; Chen, Tao; Chen, Jinying; Peng, Fei; Cao, Dong; Yang, Zhuang; Qiu, Neng; Qiu, Jingxiang; Wang, Guangcheng; Liang, Xiaolin; Peng, Aihua; Xiang, Mingli; Wei, Yuquan; Chen, Lijuan European Journal of Medicinal Chemistry, 2012 , vol. 52, p. 70 - 81

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   22
  • LogP   3.81052
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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