Cas no 35418-21-4 (N-Hexanoyl-L-valine)

N-Hexanoyl-L-valine structure
N-Hexanoyl-L-valine structure
Product Name:N-Hexanoyl-L-valine
CAS No:35418-21-4
MF:C11H21NO3
MW:215.289343595505
CID:2843048
PubChem ID:14626373
Update Time:2025-04-21

N-Hexanoyl-L-valine Chemical and Physical Properties

Names and Identifiers

    • N-caproyl-l-valine
    • AKOS010371444
    • 133849-26-0
    • 35418-21-4
    • DTXSID30562368
    • SCHEMBL6135941
    • N-Hexanoyl-L-valine
    • Valine,N-(1-oxohexyl)-
    • Inchi： 1S/C11H21NO3/c1-4-5-6-7-9(13)12-10(8(2)3)11(14)15/h8,10H,4-7H2,1-3H3,(H,12,13)(H,14,15)/t10-/m0/s1
    • InChI Key： CIXITHNTRDZSKC-JTQLQIEISA-N
    • SMILES： O=C(CCCCC)N[C@H](C(=O)O)C(C)C

Computed Properties

  • Exact Mass: 215.15214353Da
  • Monoisotopic Mass: 215.15214353Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 7
  • Complexity: 214
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.4
  • Topological Polar Surface Area: 66.4?2

N-Hexanoyl-L-valine Related Literature

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