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CS-W001157 4
Total: USD 88.00

Methyl 3,5-dimethyl-1H-pyrrole-2-carboxylate

  • CAS No. 74999-36-3

  • Cat. No. CS-0099240
  • Purity≥97%
  • MDL No.None

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

Methyl 3,5-dimethyl-1H-pyrrole-2-carboxylate|CS-0099240

Structure of 74999-36-3

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General Information

  • CAS No. 74999-36-3
  • Cat. No. CS-0099240
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₁NO₂
  • Molecular Weight 153.18
  • Synonym(s) 2,4-Dimethyl-1H-pyrrole-5-carboxylic acid methyl ester
  • SMILES O=C(C1=C(C)C=C(C)N1)OC

Synthesis

  • Route1
    • Dimethyl 2-(hydroxyimino)malonate|CS-0115544
      42937-74-6
    • null|null
      123-54-6
    • ~%
    • In-stock
      Methyl 3,5-dimethyl-1H-pyrrole-2-carboxylate|CS-0099240
      74999-36-3

    References

    • Boiadjiev, Stefan E.; Lightner, David A. Tetrahedron Asymmetry, 2002 , vol. 13, # 16 p. 1721 - 1732
  • Route2
    • null|null
      61295-92-9
    • null|null
      123-54-6
    • ~27%
    • In-stock
      Methyl 3,5-dimethyl-1H-pyrrole-2-carboxylate|CS-0099240
      74999-36-3

    References

    • Cheng, Lingjiang; Lightner, David A. Synthesis, 1999 , # 1 p. 46 - 48
  • Route3
    • null|null
      123-54-6
    • In-stock
      Dimethyl malonate|CS-0019394
      108-59-8
    • ~%
    • In-stock
      Methyl 3,5-dimethyl-1H-pyrrole-2-carboxylate|CS-0099240
      74999-36-3

    References

    • Boiadjiev, Stefan E.; Lightner, David A. Monatshefte fur Chemie, 2009 , vol. 140, # 1 p. 111 - 119

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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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