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CS-W001157 4
Total: USD 88.00

3-(Benzylamino)-4-methylpentanoic acid

  • CAS No. 118248-61-6

  • Cat. No. CS-0441993
  • Molecule weight221.30
  • Purity≥98%
  • MDL No.None

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

3-(Benzylamino)-4-methylpentanoic acid|CS-0441993

Structure of 118248-61-6

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General Information

  • CAS No. 118248-61-6
  • Cat. No. CS-0441993
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₉NO₂
  • Molecular Weight 221.30
  • Synonym(s) None
  • SMILES CC(C)C(CC(=O)O)NCC1=CC=CC=C1

Synthesis

  • Route1
    • null|null
      118248-44-5
    • ~87%
    • 3-(Benzylamino)-4-methylpentanoic acid|CS-0441993
      118248-61-6

    References

    • Dzygiel, Pawel; Monti, Chiara; Piarulli, Umberto; Gennari, Cesare Organic and Biomolecular Chemistry, 2007 ,  vol. 5,  # 21  p. 3464 - 3471
  • Route2
    • null|null
      100-46-9
    • ~%
    • 3-(Benzylamino)-4-methylpentanoic acid|CS-0441993
      118248-61-6

    References

    • Williams; Lee; Miller; Anderson Journal of the American Chemical Society, 1989 ,  vol. 111,  # 3  p. 1073 - 1081

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

Quality Control

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Computational Chemistry Data

  • TPSA   49.33
  • LogP   2.2755
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   6

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