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CS-W001157 4
Total: USD 88.00

2-Hydroxy-3-methylcyclopent-2-enone

  • CAS No. 80-71-7

  • Cat. No. CS-W013661
  • Purity≥98%
  • MDL No.MFCD00013747

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

2-Hydroxy-3-methylcyclopent-2-enone|CS-W013661

Structure of 80-71-7

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General Information

  • CAS No. 80-71-7
  • Cat. No. CS-W013661
  • Purity ≥98%
  • MDL No. MFCD00013747
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₈O₂
  • Molecular Weight 112.13
  • Synonym(s) Methylcyclopentenolone
  • SMILES CC(CC1)=C(O)C1=O

Description

.

Synthesis

  • Route1
    • 3-methylcyclopentane-1,2-diol|CS-0021855
      27583-37-5
    • ~75%
    • In-stock
      2-Hydroxy-3-methylcyclopent-2-enone|CS-W013661
      80-71-7

    References

    • Reile, Indrek; Kalle, Sigrid; Werner, Franz; Jaerving, Ivar; Kudrjashova, Marina; Paju, Anne; Lopp, Margus Tetrahedron, 2014 , vol. 70, # 22 p. 3608 - 3613
  • Route2
    • Methyl 3-methyl-2-oxocyclopentanecarboxylate|CS-0737801
      57964-61-1
    • null|null
      123-38-6
    • ~70%
    • In-stock
      2-Hydroxy-3-methylcyclopent-2-enone|CS-W013661
      80-71-7

    References

    • Kobayashi Perfumery Co., Ltd. Patent: US3963781 A1, 1976 ;
  • Route3
    • 5-Methyl-6-oxabicyclo[3.1.0]hexan-2-one|CS-1025930
      17024-44-1
    • ~75%
    • In-stock
      2-Hydroxy-3-methylcyclopent-2-enone|CS-W013661
      80-71-7

    References

    • Zhu, Rui; Xing, Lixin; Wang, Xinyan; Cheng, Chuanjie; Liu, Bo; Hu, Yuefei Synlett, 2007 , # 14 p. 2267 - 2271

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H317-H318-H402
Precautionary Statements : P261-P264-P270-P272-P273-P280-P302+P352-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   1.1813
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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