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CS-W001157 4
Total: USD 88.00

Isobutyl salicylate

  • CAS No. 87-19-4

  • Cat. No. CS-0070771
  • Purity≥97%
  • MDL No.MFCD00020035

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

Isobutyl salicylate|CS-0070771

Structure of 87-19-4

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General Information

  • CAS No. 87-19-4
  • Cat. No. CS-0070771
  • Purity ≥97%
  • MDL No. MFCD00020035
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄O₃
  • Molecular Weight 194.23
  • Synonym(s) None
  • SMILES O=C(C1=CC=CC=C1O)OCC(C)C

Synthesis

  • Route1
    • null|null
      78-83-1
    • Salicylic acid, ≥99%|CS-1268363
      69-72-7
    • ~85%
    • Isobutyl salicylate|CS-0070771
      87-19-4

    References

    • Organic Letters, , vol. 7, # 22 p. 5047 - 5050 Tetrahedron, , vol. 63, # 35 p. 8645 - 8657
  • Route2
    • null|null
      78-83-1
    • null|null
      94-36-0
    • ~%
    • Isobutyl salicylate|CS-0070771
      87-19-4
    • 4-Isobutoxybenzoic acid|CS-0450841
      30762-00-6
    • null|null
      15719-64-9
    • In-stock
      [1,1'-Biphenyl]-4-carboxylic acid|CS-D1119
      92-92-2

    References

    • Chemische Berichte, , vol. 58, p. 768

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   2.205
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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