Cas no 34522-31-1 (N~2~-[(1R)-1-carboxyethyl]-L-lysine)

N~2~-[(1R)-1-carboxyethyl]-L-lysine structure
34522-31-1 structure
Product Name:N~2~-[(1R)-1-carboxyethyl]-L-lysine
CAS No:34522-31-1
MF:C9H18N2O4
MW:218.250222682953
CID:1464566
PubChem ID:193187
Update Time:2025-04-20

N~2~-[(1R)-1-carboxyethyl]-L-lysine Chemical and Physical Properties

Names and Identifiers

    • N~2~-[(1R)-1-carboxyethyl]-L-lysine
    • CHEBI:17213
    • Lysopine
    • N(2)-(D-1-carboxyethyl)-L-lysine
    • AKOS040752847
    • N2-(D-1-Carboxyethyl)-L-lysine
    • DTXSID80188072
    • (R)-N(2)-(1-Carboxyethyl)-L-lysine
    • N(2)-[(1R)-1-carboxyethyl]-L-lysine
    • 34522-31-1
    • D-Lysopine
    • (2S)-6-azaniumyl-2-{[(1R)-1-carboxylatoethyl]azaniumyl}hexanoate
    • C04020
    • (2S)-6-amino-2-[[(1R)-1-carboxyethyl]amino]hexanoic acid
    • Q27102265
    • Inchi: 1S/C9H18N2O4/c1-6(8(12)13)11-7(9(14)15)4-2-3-5-10/h6-7,11H,2-5,10H2,1H3,(H,12,13)(H,14,15)/t6-,7+/m1/s1
    • InChI Key: ZZYYVZYAZCMNPG-RQJHMYQMSA-N
    • SMILES: OC([C@H](CCCCN)N[C@@H](C(=O)O)C)=O

Computed Properties

  • Exact Mass: 218.12674
  • Monoisotopic Mass: 218.127
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 8
  • Complexity: 220
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -5
  • Topological Polar Surface Area: 113?2

Experimental Properties

  • Density: 1.215
  • Boiling Point: 424.1°C at 760 mmHg
  • Flash Point: 210.3°C
  • Refractive Index: 1.512
  • PSA: 112.65
  • LogP: 0.72250
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