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Substance Name: N(1)-(2-Formylethyl)-5-fluorouracil
RN: 56058-99-2
InChIKey: NALBVYNGIWXLJJ-UHFFFAOYSA-N

Molecular Formula

  • C7-H7-F-N2-O3

Molecular Weight

  • 186.1413
 
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Names and Synonyms

Name of Substance

  • N(1)-(2-Formylethyl)-5-fluorouracil

Synonym

  • FE-FU

Systematic Name

  • 2,4(1H,3H)-Pyrimidinedione, 5-fluoro-1-(1-oxopropyl)-

Registry Numbers

CAS Registry Number

  • 56058-99-2

System Generated Number

  • 0056058992

Structure Descriptors

InChI

1S/C7H7FN2O3/c1-2-5(11)10-6(12)4(8)3-9-7(10)13/h3H,2H2,1H3,(H,9,13)

InChIKey

NALBVYNGIWXLJJ-UHFFFAOYSA-N

Smiles

CCC(=O)n1c(=O)c(c[nH]c1=O)F

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.19 (none)   EXP
Water Solubility 1730 mg/L 25 EST
Vapor Pressure 4.85E-08 mm Hg 25 EST
Henry's Law Constant 7.14E-13 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.06E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.