Cas no 121080-96-4 (D-Homocitrulline)

D-Homocitrulline structure
D-Homocitrulline structure
Product Name:D-Homocitrulline
CAS No:121080-96-4
MF:C7H15N3O3
MW:189.212301492691
MDL:MFCD00237406
CID:137051
PubChem ID:7000023
Update Time:2025-04-19

D-Homocitrulline Chemical and Physical Properties

Names and Identifiers

    • (R)-2-Amino-6-ureidohexanoic acid
    • D-Homocitrulline
    • D-Homoserine
    • D-Lysine,N6-(aminocarbonyl)-
    • H-D-Hcit-OH
    • H-D-Homocit-OH
    • H-D-HCI-OH
    • D-HOCIT-OH
    • H-D-HOCIT-OH
    • D-HomoCit-OH
    • D-homocitruline
    • H-D-LYS(CONH2)-OH
    • H-D-LYS(CARBAMOYL)-OH
    • (2R)-2-amino-6-(carbamoylamino)hexanoic acid
    • J-004439
    • (2R)-2-azaniumyl-6-(carbamoylamino)hexanoate
    • MFCD00237406
    • (R)-2-Amino-6-ureidohexanoicacid
    • Homocitrulline, D-
    • SCHEMBL8871251
    • N6-(Aminocarbonyl)-D-lysine
    • AS-10227
    • 837O9SMA7A
    • D-Homo-citrulline (H-D-hCit-OH)
    • UNII-837O9SMA7A
    • DTXSID80426461
    • N-Epsilon-carbamoyl-D-lysine
    • 121080-96-4
    • (2R)-2-Ammonio-6-(carbamoylamino)hexanoate
    • A891964
    • D-Lysine, N6-(aminocarbonyl)-
    • AKOS016843065
    • MDL: MFCD00237406
    • Inchi: 1S/C7H15N3O3/c8-5(6(11)12)3-1-2-4-10-7(9)13/h5H,1-4,8H2,(H,11,12)(H3,9,10,13)/t5-/m1/s1
    • InChI Key: XIGSAGMEBXLVJJ-RXMQYKEDSA-N
    • SMILES: OC([C@@H](CCCCNC(N)=O)N)=O

Computed Properties

  • Exact Mass: 411.17955
  • Monoisotopic Mass: 189.111
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 7
  • Complexity: 184
  • 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: _3.9
  • Topological Polar Surface Area: 118A^2

Experimental Properties

  • Density: 1.241
  • Boiling Point: 392.954 °C at 760 mmHg
  • Flash Point: 191.452 °C
  • PSA: 130.75
  • LogP: 1.02840

D-Homocitrulline Security Information

  • Storage Condition:-15°C

D-Homocitrulline Pricemore >>

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