Cas no 74173-51-6 (1-(5-Oxohexylcarbamoyl)-5-fluorouracil)

1-(5-Oxohexylcarbamoyl)-5-fluorouracil structure
74173-51-6 structure
Product Name:1-(5-Oxohexylcarbamoyl)-5-fluorouracil
CAS No:74173-51-6
MF:C11H14FN3O4
MW:271.244966030121
CID:573315
Update Time:2023-08-02

1-(5-Oxohexylcarbamoyl)-5-fluorouracil Chemical and Physical Properties

Names and Identifiers

    • 1(2H)-Pyrimidinecarboxamide,5-fluoro-3,4-dihydro-2,4-dioxo-N-(5-oxohexyl)-
    • 1-(5'-oxohexylcarbamoyl)-5-fluorouracil
    • OHCFU
    • 1-(5-oxohexylcarbamoyl)-5-fluorouracil
    • 5-Fluoro-4-hydroxy-2-oxo-N-(5-oxohexyl)pyrimidine-1(2H)-carboximidic acid
    • 1(2H)-Pyrimidinecarboxamide, 5-fluoro-3,4-dihydro-2,4-dioxo-N-(5-oxohexyl)-
    • 1-(5-Oxohexylcarbamoyl)-5-fluorouracil
    • Inchi: 1S/C11H14FN3O4/c1-7(16)4-2-3-5-13-10(18)15-6-8(12)9(17)14-11(15)19/h6H,2-5H2,1H3,(H,13,18)(H,14,17,19)
    • InChI Key: FEUSBCKCVPGBRS-UHFFFAOYSA-N
    • SMILES: FC1C(NC(N(C=1)C(NCCCCC(C)=O)=O)=O)=O

Computed Properties

  • Exact Mass: 271.097
  • Monoisotopic Mass: 271.097
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 5
  • Complexity: 447
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.6
  • Topological Polar Surface Area: 95.6

Experimental Properties

  • Density: 1.35
  • Refractive Index: 1.535
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