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CS-W001157 4
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Methyl 2-acetylpent-4-enoate

  • CAS No. 3897-04-9

  • Cat. No. CS-0227270
  • Molecule weight156.18
  • Purity≥98%
  • MDL No.None

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

Methyl 2-acetylpent-4-enoate|CS-0227270

Structure of 3897-04-9

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General Information

  • CAS No. 3897-04-9
  • Cat. No. CS-0227270
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₂O₃
  • Molecular Weight 156.18
  • Synonym(s) 4-Pentenoic acid, 2-acetyl-, methyl ester
  • SMILES C=CCC(C(C)=O)C(OC)=O

Synthesis

  • Route1

    References

    • Goorbergh, J. A. M. van den; Gen, A. van der Recueil: Journal of the Royal Netherlands Chemical Society, 1984 , vol. 103, # 3 p. 90 - 96
  • Route2

    References

    • Rao Volla, Chandra M.; Dubbaka, Srinivas Reddy; Vogel, Pierre Tetrahedron, 2009 , vol. 65, # 2 p. 504 - 511
  • Route3

    References

    • Zhang, Yang; Raines, Andrew J.; Flowers II, Robert A. Organic Letters, 2003 , vol. 5, # 13 p. 2363 - 2365

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+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   0.9407
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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