Cas no 2794-13-0 (2,4(1H,3H)-Pyrimidinedione-6-14C,5-fluoro- (9CI))

2,4(1H,3H)-Pyrimidinedione-6-14C,5-fluoro- (9CI) structure
2794-13-0 structure
Product Name:2,4(1H,3H)-Pyrimidinedione-6-14C,5-fluoro- (9CI)
CAS No:2794-13-0
MF:C4H3FN2O2
MW:132.069765329361
CID:240190
PubChem ID:53837959
Update Time:2025-04-19

2,4(1H,3H)-Pyrimidinedione-6-14C,5-fluoro- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 2,4(1H,3H)-Pyrimidinedione-6-14C,5-fluoro- (9CI)
    • [14C]-5-Fluorouracil
    • 1-CHLORO-5-FLUORO-ISOQUINOLINE
    • 5-fluoro-1-chloroisoquinoline
    • 5-fluoro-1H-[6-14C]pyrimidine-2,4-dione
    • 5-Fluoruracil-6-14C
    • 2794-13-0
    • 5-FLUOROURACIL-6-14C
    • Inchi: 1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)/i1+2
    • InChI Key: GHASVSINZRGABV-NJFSPNSNSA-N
    • SMILES: FC1=[14CH]NC(NC1=O)=O

Computed Properties

  • Exact Mass: 132.021
  • Monoisotopic Mass: 132.021
  • Isotope Atom Count: 1
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 199
  • 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: _0.9
  • Topological Polar Surface Area: 58.2?2

Experimental Properties

  • Flash Point: 25?°C

2,4(1H,3H)-Pyrimidinedione-6-14C,5-fluoro- (9CI) Security Information

  • Hazardous Material transportation number:UN 2910 7
  • Hazard Category Code: 46-60-61-10-22-36/37/38
  • Safety Instruction: 53-16-26-36/37/39-45
  • Hazardous Material Identification: T
  • Risk Phrases:46-60-61-10-22-36/37/38
  • Storage Condition:2-8°C
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