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CS-W001157 4
Total: USD 88.00

3-Butyramidobenzoic acid

  • CAS No. 76209-00-2

  • Cat. No. CS-0312952
  • Purity95+%
  • MDL No.None

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

3-Butyramidobenzoic acid|CS-0312952

Structure of 76209-00-2

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General Information

  • CAS No. 76209-00-2
  • Cat. No. CS-0312952
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃NO₃
  • Molecular Weight 207.23
  • Synonym(s) 3-(Butyrylamino)benzoic acid
  • SMILES CCCC(NC1=CC=CC(C(O)=O)=C1)=O

Synthesis

  • Route1

    References

    • Krauss, Juergen; Knorr, Veronika; Manhardt, Vera; Scheffels, Stefanie; Bracher, Franz Archiv der Pharmazie, 2008 , vol. 341, # 6 p. 386 - 392
  • Route2

    References

    • Pellizzari Gazzetta Chimica Italiana, 1885 , vol. 15, p. 567 Justus Liebigs Annalen der Chemie, 1886 , vol. 232, p. 153

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   66.4
  • LogP   2.1234
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   4

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