Product Name

  • Name

    3-FT

  • EINECS
  • CAS No. 63901-83-7
  • Article Data11
  • CAS DataBase
  • Density 1.45g/cm3
  • Solubility
  • Melting Point
  • Formula C8H9 F N2 O3
  • Boiling Point
  • Molecular Weight 200.169
  • Flash Point
  • Transport Information
  • Appearance
  • Safety Moderately toxic by ingestion. Mutation data reported. When heated to decomposition it emits toxic vapors of NOx and F−.
  • Risk Codes
  • Molecular Structure Molecular Structure of 63901-83-7 (3-FT)
  • Hazard Symbols Moderately toxic by ingestion.
  • Synonyms 3-(2-Tetrahydrofuryl)-5-fluorouracil;3-FT; 5-Fluoro-3-(tetrahydro-2-furanyl)-2,4-pyrimidinedione
  • PSA 64.35000
  • LogP 0.39700

5-Fluoro-3-(tetrahydro-2-furyl)uracil Chemical Properties

Molecule structure of 5-Fluoro-3-(tetrahydro-2-furyl)uracil (CAS NO.63901-83-7):

IUPAC Name: 5-Fluoro-3-(oxolan-2-yl)-1H-pyrimidine-2,4-dione 
Molecular Weight: 200.167063 g/mol
Molecular Formula: C8H9FN2O3 
Density: 1.45 g/cm3
Index of Refraction: 1.557
Molar Refractivity: 44.28 cm3
Molar Volume: 137.4 cm3
Polarizability: 17.55×10-24 cm3
Surface Tension: 51.1 dyne/cm
H-Bond Donor: 1
H-Bond Acceptor: 4
Rotatable Bond Count: 1
Tautomer Count: 4
Exact Mass: 200.05972
MonoIsotopic Mass: 200.05972
Topological Polar Surface Area: 58.6
Heavy Atom Count: 14
Complexity: 316
Canonical SMILES: C1CC(OC1)N2C(=O)C(=CNC2=O)F
InChI: InChI=1S/C8H9FN2O3/c9-5-4-10-8(13)11(7(5)12)6-2-1-3-14-6/h4,6H,1-3H2,(H,10,13)
InChIKey: MGYWDJWGVICAEL-UHFFFAOYSA-N
Classification Code of 5-Fluoro-3-(tetrahydro-2-furyl)uracil (CAS NO.63901-83-7): Mutation data

5-Fluoro-3-(tetrahydro-2-furyl)uracil Toxicity Data With Reference

1.    

cyt-ham-fbr 10 nmol/L

     MUREAV    Mutation Research. 88 (1981),241.
2.    

orl-mus LD50:1021 mg/kg

     USXXAM    United States Patent Document. (Commissioner of Patents and Trademarks, Washington, DC 20231) #4650801 .

5-Fluoro-3-(tetrahydro-2-furyl)uracil Safety Profile

Moderately toxic by ingestion. Mutation data reported. When heated to decomposition it emits toxic vapors of NOx and F−.

5-Fluoro-3-(tetrahydro-2-furyl)uracil Specification

 5-Fluoro-3-(tetrahydro-2-furyl)uracil (CAS NO.63901-83-7) is also named as 3-(2-Tetrahydrofuryl)-5-fluorouracil ; 3-FT ; Uracil, 5-fluoro-3-(tetrahydro-2-furyl)- .

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