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CS-W001157 4
Total: USD 88.00

Methyl 2,4-dimethyl-1H-pyrrole-3-carboxylate

  • CAS No. 52459-90-2

  • Cat. No. CS-0453302
  • Molecule weight153.18
  • Purity≥98%
  • MDL No.None

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

Methyl 2,4-dimethyl-1H-pyrrole-3-carboxylate|CS-0453302

Structure of 52459-90-2

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General Information

  • CAS No. 52459-90-2
  • Cat. No. CS-0453302
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₁NO₂
  • Molecular Weight 153.18
  • Synonym(s) 2,4-Dimethyl-1H-pyrrole-3-carboxylic acid methyl ester
  • SMILES CC1=CNC(=C1C(=O)OC)C

Synthesis

  • Route1
    • Methyl 5-acetyl-2,4-dimethyl-1H-pyrrole-3-carboxylate|CS-0322797
      62264-99-7
    • ~79%
    • Methyl 2,4-dimethyl-1H-pyrrole-3-carboxylate|CS-0453302
      52459-90-2

    References

    • Moon, M. W.; Wade, R. A. Journal of Organic Chemistry, 1984 , vol. 49, # 15 p. 2663 - 2669
  • Route2
    • Methyl 5-acetyl-2,4-dimethyl-1H-pyrrole-3-carboxylate|CS-0322797
      62264-99-7
    • ~0%
    • Methyl 2,4-dimethyl-1H-pyrrole-3-carboxylate|CS-0453302
      52459-90-2
    • null|null
      90433-74-2

    References

    • Moon, M. W.; Wade, R. A. Journal of Organic Chemistry, 1984 , vol. 49, # 15 p. 2663 - 2669
  • Route3
    • null|null
      90433-95-7
    • ~0%
    • Methyl 2,4-dimethyl-1H-pyrrole-3-carboxylate|CS-0453302
      52459-90-2
    • null|null
      90433-94-6
    • Methyl 1,2,4-trimethyl-1H-pyrrole-3-carboxylate|CS-0120528
      14186-59-5

    References

    • Moon, M. W.; Wade, R. A. Journal of Organic Chemistry, 1984 , vol. 49, # 15 p. 2663 - 2669

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-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   42.09
  • LogP   1.41814
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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