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CS-W001157 4
Total: USD 88.00

4-(Benzylcarbamoyl)butanoic acid

  • CAS No. 42856-45-1

  • Cat. No. CS-0232707
  • Purity95+%
  • MDL No.None

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

4-(Benzylcarbamoyl)butanoic acid|CS-0232707

Structure of 42856-45-1

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General Information

  • CAS No. 42856-45-1
  • Cat. No. CS-0232707
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₅NO₃
  • Molecular Weight 221.25
  • Synonym(s) N-Benzyl-glutaramidsaeure
  • SMILES O=C(O)CCCC(NCC1=CC=CC=C1)=O

Synthesis

  • Route1
    • null|null
      108-55-4
    • null|null
      100-46-9
    • ~93%
    • 4-(Benzylcarbamoyl)butanoic acid|CS-0232707
      42856-45-1

    References

    • Bisset, Alexander A.; Shiibashi, Akira; Desmond, Jasmine L.; Dishington, Allan; Jones, Teyrnon; Clarkson, Guy J.; Ikariya, Takao; Wills, Martin Chemical Communications, 2012 , vol. 48, # 98 p. 11978 - 11980
  • Route2
    • In-stock
      Glutaric acid|CS-W009536
      110-94-1
    • null|null
      100-46-9
    • ~%
    • null|null
      42856-47-3
    • 4-(Benzylcarbamoyl)butanoic acid|CS-0232707
      42856-45-1

    References

    • Onda; Kunugi Yakugaku Zasshi, 1958 , vol. 78, p. 690 Chem.Abstr., 1958 , p. 18304

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P363-P501

Quality Control

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Computational Chemistry Data

  • TPSA   66.4
  • LogP   1.5577
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   6

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