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CS-W001157 4
Total: USD 88.00

Isoamyl benzoate

  • CAS No. 94-46-2

  • Cat. No. CS-0154227
  • Purity≥97%
  • MDL No.MFCD00026515

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

Isoamyl benzoate|CS-0154227

Structure of 94-46-2

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General Information

  • CAS No. 94-46-2
  • Cat. No. CS-0154227
  • Purity ≥97%
  • MDL No. MFCD00026515
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆O₂
  • Molecular Weight 192.25
  • Synonym(s) Isopentyl benzoate
  • SMILES O=C(C1=CC=CC=C1)OCCC(C)C

Synthesis

  • Route1

    References

    • Yi, Wen-Bin; Cai, Chun Journal of Fluorine Chemistry, 2008 , vol. 129, # 6 p. 524 - 528
  • Route2
    • null|null
      108-86-1
    • null|null
      123-51-3
    • null|null
      201230-82-2
    • ~71%
    • In-stock
      Isoamyl benzoate|CS-0154227
      94-46-2
    • In-stock
      Benzoic acid|CS-0008257
      65-85-0

    References

    • Journal of Organic Chemistry, , vol. 60, # 26 p. 8336 - 8340
  • Route3
    • null|null
      123-51-3
    • null|null
      98-88-4
    • ~74%
    • In-stock
      Isoamyl benzoate|CS-0154227
      94-46-2

    References

    • Bandgar; Kamble; Sadavarte; Uppalla Synlett, 2002 , # 5 p. 735 - 738

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
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.8895
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   4

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