Cas no 54746-52-0 (L-Methionine,N-(1-oxobutyl)-)

L-Methionine,N-(1-oxobutyl)- structure
L-Methionine,N-(1-oxobutyl)- structure
Product Name:L-Methionine,N-(1-oxobutyl)-
CAS No:54746-52-0
MF:C9H17NO3S
MW:219.301181554794
CID:377801
PubChem ID:6453068
Update Time:2025-04-19

L-Methionine,N-(1-oxobutyl)- Chemical and Physical Properties

Names and Identifiers

    • L-Methionine,N-(1-oxobutyl)-
    • (2S)-2-(butanoylamino)-4-methylsulfanylbutanoic acid
    • N-(1-oxobutyl)-L-methionine
    • N-butanoyl-L-methionine
    • DTXSID10203207
    • NS00033188
    • 54746-52-0
    • EINECS 259-316-4
    • N-butyryl-l-methionine
    • SCHEMBL302152
    • Inchi: 1S/C9H17NO3S/c1-3-4-8(11)10-7(9(12)13)5-6-14-2/h7H,3-6H2,1-2H3,(H,10,11)(H,12,13)/t7-/m0/s1
    • InChI Key: NZIOTNYOYJRBSN-ZETCQYMHSA-N
    • SMILES: S(C)CC[C@@H](C(=O)O)NC(CCC)=O

Computed Properties

  • Exact Mass: 219.09301
  • Monoisotopic Mass: 219.09291458g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 7
  • Complexity: 197
  • 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: 1
  • Topological Polar Surface Area: 91.7?2

Experimental Properties

  • PSA: 66.4
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