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CS-W001157 4
Total: USD 88.00

3-Propylisobenzofuran-1(3H)-one

  • CAS No. 72424-08-9

  • Cat. No. CS-0571331
  • Purity≥98%
  • MDL No.None

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

3-Propylisobenzofuran-1(3H)-one|CS-0571331

Structure of 72424-08-9

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General Information

  • CAS No. 72424-08-9
  • Cat. No. CS-0571331
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₂O₂
  • Molecular Weight 176.21
  • Synonym(s) 1(3H)-Isobenzofuranone,3-propyl
  • SMILES CCCC1C2=CC=CC=C2C(=O)O1

Synthesis

  • Route1

    References

    • Berlingozzi; Cione Gazzetta Chimica Italiana, 1927 , vol. 57, p. 247 Gazzetta Chimica Italiana, 1927 , vol. 57, p. 254 Show Details Tasman Recueil des Travaux Chimiques des Pays-Bas, 1927 , vol. 46, p. 661,923
  • Route2

    References

    • Chang, Hong-Tai; Jeganmohan, Masilamani; Cheng, Chien-Hong Chemistry - A European Journal, 2007 , vol. 13, # 15 p. 4356 - 4363
  • Route3

    References

    • Rayabarapu, Dinesh Kumar; Chang, Hong-Tai; Cheng, Chien-Hong Chemistry - A European Journal, 2004 , vol. 10, # 12 p. 2991 - 2996

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   26.3
  • LogP   2.6982
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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