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CS-W001157 4
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Ethyl 2-acetyl-4-oxopentanoate

  • CAS No. 41892-81-3

  • Cat. No. CS-0116694
  • Molecule weight186.21
  • Purity95+%
  • MDL No.None

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

Ethyl 2-acetyl-4-oxopentanoate|CS-0116694

Structure of 41892-81-3

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General Information

  • CAS No. 41892-81-3
  • Cat. No. CS-0116694
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₄O₄
  • Molecular Weight 186.21
  • Synonym(s) None
  • SMILES CC(CC(C(C)=O)C(OCC)=O)=O

Synthesis

  • Route1

    References

    • Sizov, A. Yu.; Yanovskaya, L. A.; Dombrovskii, V. A. Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation), 1990 , vol. 39, # 2.2 p. 410 - 411 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1990 , # 2 p. 473 - 474
  • Route2

    References

    • Gu, Xue-Ping; Nishida, Nobuyuki; Ikeda, Isao; Okahara, Mitsuo Journal of Organic Chemistry, 1987 , vol. 52, # 15 p. 3192 - 3196
  • Route3
    • null|null
      122132-58-5
    • ~70%
    • Ethyl 2,5-dimethyl-furan-3-carboxylate|CS-0342183
      29113-63-1
    • Ethyl 2-acetyl-4-oxopentanoate|CS-0116694
      41892-81-3

    References

    • Antonioletti, Roberto; Bonadies, Francesco; Scettri, Arrigo Gazzetta Chimica Italiana, 1991 , vol. 121, # 5 p. 233 - 234

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

Quality Control

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Computational Chemistry Data

  • TPSA   60.44
  • LogP   0.7338
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   5

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