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CS-W001157 4
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Methyl 2-(2-oxocyclopentyl)acetate

  • CAS No. 4934-95-6

  • Cat. No. CS-0231139
  • Purity≥97%
  • MDL No.None

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

Methyl 2-(2-oxocyclopentyl)acetate|CS-0231139

Structure of 4934-95-6

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General Information

  • CAS No. 4934-95-6
  • Cat. No. CS-0231139
  • Purity ≥97%
  • 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) (2-OXO-CYCLOPENTYL)-ACETIC ACID METHYL ESTER
  • SMILES O=C(OC)CC1C(CCC1)=O

Synthesis

  • Route1

    References

    • Gingras, Marc; Chabre, Yoann M.; Raimundo Synthesis, 2006 , # 1 art. no. Z09605SS, p. 182 - 185
  • Route2
    • null|null
      77982-78-6
    • ~89%
    • Methyl 2-(2-oxocyclopentyl)acetate|CS-0231139
      4934-95-6

    References

    • Kunkel, Elisabeth; Reichelt, Ingrid; Reissig, Hans-Ulrich Liebigs Annalen der Chemie, 1984 , # 4 p. 802 - 819
  • Route3
    • null|null
      2018-86-2
    • ~90%
    • Methyl 2-(2-oxocyclopentyl)acetate|CS-0231139
      4934-95-6

    References

    • Yoshikai, Kazuya; Hayama, Tomoharu; Nishimura, Katsumi; Yamada, Ken-Ichi; Tomioka, Kiyoshi Journal of Organic Chemistry, 2005 , vol. 70, # 2 p. 681 - 683

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   43.37
  • LogP   0.9187
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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