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CS-W001157 4
Total: USD 88.00

3-Ethyl-tetrahydro-pyran-4-one

  • CAS No. 21398-42-5

  • Cat. No. CS-0342739
  • Molecule weight128.17
  • Purity≥95%
  • MDL No.None

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

3-Ethyl-tetrahydro-pyran-4-one|CS-0342739

Structure of 21398-42-5

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General Information

  • CAS No. 21398-42-5
  • Cat. No. CS-0342739
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₂O₂
  • Molecular Weight 128.17
  • Synonym(s) 3-Ethyloxan-4-one
  • SMILES CCC1COCCC1=O

Synthesis

  • Route1

    References

    • ABBOTT LABORATORIES; ABOTT LABORATORIES TRADING (SHANGHAI)COMPANY, LTD.; MEYER, Michael D.; WANG, Xueqing; GUO, Tao; WEI, Robert; WANG, Lijuan Jane Patent: WO2013/149376 A1, 2013 ; Location in patent: Page/Page column 110 ;
  • Route2

    References

    • MERCK and CO., INC.; MERCK SHARP and DOHME LIMITED Patent: WO2003/93231 A2, 2003 ; Location in patent: Page/Page column 94 ; WO 03/093231 A2

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H227-H315-H319-H335
Precautionary Statements : P210-P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P370+P378-P403-P405-P501

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   1.002
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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