Cas no 121071-26-9 (L-Serine, ethylhydrogen phosphate (ester) (9CI))

L-Serine, ethylhydrogen phosphate (ester) (9CI) structure
121071-26-9 structure
Product Name:L-Serine, ethylhydrogen phosphate (ester) (9CI)
CAS No:121071-26-9
MF:C5H12NO6P
MW:213.125642776489
CID:213816
PubChem ID:3035913
Update Time:2025-04-19

L-Serine, ethylhydrogen phosphate (ester) (9CI) Chemical and Physical Properties

Names and Identifiers

    • L-Serine, ethylhydrogen phosphate (ester) (9CI)
    • (2S)-2-amino-3-[ethoxy(hydroxy)phosphoryl]oxypropanoic acid
    • O-phosphoserine-P-ethyl ester
    • L-Serine, ethyl hydrogen phosphate (ester)
    • O-[ethoxy(hydroxy)phosphoryl]-L-serine
    • O-Phospho-L-serine-P-ethyl ester
    • O-Pspee
    • 121071-26-9
    • O-[(S)-ethoxy(hydroxy)phosphoryl]-L-serine
    • Q27463171
    • DTXSID40153140
    • MONOETHYLPHOSPHORYLSERINE
    • Inchi: 1S/C5H12NO6P/c1-2-11-13(9,10)12-3-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10)/t4-/m0/s1
    • InChI Key: ULHXUTHSGPNKSO-BYPYZUCNSA-N
    • SMILES: P(=O)(O)(OCC)OC[C@@H](C(=O)O)N

Computed Properties

  • Exact Mass: 213.04026
  • Monoisotopic Mass: 213.04022410g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 6
  • Complexity: 219
  • 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: -4.2
  • Topological Polar Surface Area: 119?2

Experimental Properties

  • PSA: 119.08

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