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CS-W001157 4
Total: USD 88.00

Octyl Benzoate

  • CAS No. 94-50-8

  • Cat. No. CS-0162958
  • Purity≥95%
  • MDL No.None

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

Octyl Benzoate|CS-0162958

Structure of 94-50-8

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General Information

  • CAS No. 94-50-8
  • Cat. No. CS-0162958
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₂₂O₂
  • Molecular Weight 234.33
  • Synonym(s) n-Octyl benzoate
  • SMILES O=C(OCCCCCCCC)C1=CC=CC=C1

Synthesis

  • Route1

    References

    • Procopio, Antonio; Dalpozzo, Renato; De Nino, Antonio; Maiuolo, Loredana; Russo, Beatrice; Sindona, Giovanni Advanced Synthesis and Catalysis, 2004 , vol. 346, # 12 p. 1465 - 1470
  • Route2

    References

    • Oda, Yoshiro; Hirano, Koji; Satoh, Tetsuya; Kuwabata, Susumu; Miura, Masahiro Tetrahedron Letters, 2011 , vol. 52, # 41 p. 5392 - 5394
  • Route3

    References

    • Ram, Ram N.; Soni, Vineet Kumar; Gupta, Dharmendra Kumar Tetrahedron, 2012 , vol. 68, # 44 p. 9068 - 9075

Safety Information

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

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   4.2039
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   8

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