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CS-W001157 4
Total: USD 88.00

4,5,6,7-Tetrahydrobenzo[d]isoxazol-3-ol

  • CAS No. 27772-90-3

  • Cat. No. CS-0271681
  • Purity≥97%
  • MDL No.None

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

4,5,6,7-Tetrahydrobenzo[d]isoxazol-3-ol|CS-0271681

Structure of 27772-90-3

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General Information

  • CAS No. 27772-90-3
  • Cat. No. CS-0271681
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉NO₂
  • Molecular Weight 139.15
  • Synonym(s) 4,5,6,7-TETRAHYDRO-BENZO[D]ISOXAZOL-3-OL
  • SMILES C1CCC2=C(C1)C(=NO2)O

Synthesis

  • Route1

    References

    • Clausen, Rasmus P.; Naur, Peter; Kristensen, Anders S.; Greenwood, Jeremy R.; Strange, Mette; Brauner-Osborne, Hans; Jensen, Anders A.; Nielsen, Anne Sophie T.; Geneser, Ulla; Ringgaard, Lone M.; Nielsen, Birgitte; Pickering, Darryl S.; Brehm, Lotte; Gajhede, Michael; Krogsgaard-Larsen, Povl; Kastrup, Jette S. Journal of Medicinal Chemistry, 2009 , vol. 52, # 15 p. 4911 - 4922
  • Route2
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      27773-01-9
    • ~%
    • 4,5,6,7-Tetrahydrobenzo[d]isoxazol-3-ol|CS-0271681
      27772-90-3

    References

    • Jacquier,R. et al. Bulletin de la Societe Chimique de France, 1970 , p. 1978 - 1985
  • Route3

    References

    • Jacobsen; Kolind-Andersen; Christensen Canadian Journal of Chemistry, 1984 , vol. 62, # 10 p. 1940 - 1944

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

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Computational Chemistry Data

  • TPSA   46.26
  • LogP   1.259
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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