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CS-W001157 4
Total: USD 88.00

4-Hexanamidobenzoic acid

  • CAS No. 109506-41-4

  • Cat. No. CS-0577902
  • Purity≥98%
  • MDL No.None

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

4-Hexanamidobenzoic acid|CS-0577902

Structure of 109506-41-4

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General Information

  • CAS No. 109506-41-4
  • Cat. No. CS-0577902
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₇NO₃
  • Molecular Weight 235.28
  • Synonym(s) 4-(hexanoylamino)benzoic Acid
  • SMILES CCCCCC(=O)NC1=CC=C(C=C1)C(=O)O

Synthesis

  • Route1
    • 4-Aminobenzoic acid Conivaptan Impurity|CS-0213989
      150-13-0
    • null|null
      142-61-0
    • ~89%
    • 4-Hexanamidobenzoic acid|CS-0577902
      109506-41-4

    References

    • Goeker, H.; Ayhan, G.; Tuncbilek, M.; Ertan, R.; Leoncini, G.; et al. European Journal of Medicinal Chemistry, 1995 , vol. 30, # 7-8 p. 561 - 568

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

Quality Control

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Computational Chemistry Data

  • TPSA   66.4
  • LogP   2.9036
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   6

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