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CS-W001157 4
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1-Benzyl-2,5-dimethyl-1h-pyrrole-3-carbaldehyde

  • CAS No. 56018-32-7

  • Cat. No. CS-0240223
  • Molecule weight213.28
  • Purity≥98%
  • MDL No.None

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

1-Benzyl-2,5-dimethyl-1h-pyrrole-3-carbaldehyde|CS-0240223

Structure of 56018-32-7

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General Information

  • CAS No. 56018-32-7
  • Cat. No. CS-0240223
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₅NO
  • Molecular Weight 213.28
  • Synonym(s) UKRORGSYN-BB BBV-094920
  • SMILES CC1=CC(=C(C)N1CC2=CC=CC=C2)C=O

Synthesis

  • Route1
    • 1-Benzyl-2,5-dimethylpyrrole|CS-0207466
      5044-20-2
    • null|null
      68-12-2
    • ~95%
    • 1-Benzyl-2,5-dimethyl-1h-pyrrole-3-carbaldehyde|CS-0240223
      56018-32-7

    References

    • Murugesan, Dinakaran; Mital, Alka; Kaiser, Marcel; Shackleford, David M.; Morizzi, Julia; Katneni, Kasiram; Campbell, Michael; Hudson, Alan; Charman, Susan A.; Yeates, Clive; Gilbert, Ian H. Journal of Medicinal Chemistry, 2013 , vol. 56, # 7 p. 2975 - 2990
  • Route2

    References

    • Gangjee, Aleem; Patel, Jasmin; Kisliuk, Roy L.; Gaumont, Yvette Journal of Medicinal Chemistry, 1992 , vol. 35, # 20 p. 3678 - 3685
  • Route3
    • null|null
      100-46-9
    • ~%
    • 1-Benzyl-2,5-dimethyl-1h-pyrrole-3-carbaldehyde|CS-0240223
      56018-32-7

    References

    • Gangjee, Aleem; Patel, Jasmin; Kisliuk, Roy L.; Gaumont, Yvette Journal of Medicinal Chemistry, 1992 , vol. 35, # 20 p. 3678 - 3685

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-H317-H319-H335
Precautionary Statements : P261-P264-P270-P271-P272-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   22
  • LogP   2.96574
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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