5-Fluorouracil-15N2

Base Information

• Chemical Name: 5-Fluorouracil-15N2
• CAS No.: 68941-95-7
• Molecular Formula: C4H3FN2O2
• Molecular Weight: 132.1
• European Community (EC) Number: 685-855-3
• DSSTox Substance ID: DTXSID60584013
• Nikkaji Number: J2.557.237H
• Wikidata: Q82475637
• Mol file: 68941-95-7.mol

Synonyms:5-Fluorouracil-15N2;68941-95-7;5-fluoro-(1,3-15N2)1H-pyrimidine-2,4-dione;DTXSID60584013;HY-90006S2;MS-22778;5-Fluorouracil-15N2, 98 atom % 15N;CS-0255678;F90912;5-Fluoro(~15~N_2_)pyrimidine-2,4(1H,3H)-dione

Chemical Property of 5-Fluorouracil-15N2

Chemical Property:

• Melting Point: 282-286 °C(lit.)
• PSA: 65.72000
• LogP: -0.79770
• Storage Temp.: -20°C
• XLogP3: -0.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 132.01192529
• Heavy Atom Count: 9
• Complexity: 199

Purity/Quality:

5-FLUOROURACIL-15N2 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=C(C(=O)NC(=O)N1)F
• Isomeric SMILES: C1=C(C(=O)[15NH]C(=O)[15NH]1)F
• Uses: 5-Fluorouracil-15N2 (CAS# 68941-95-7) is a useful isotopically labeled research compound. This compound can be used for isotopic analysis by gas chromatography-mass spectroscopy for various pyrimidine metabolites and antimetabolites.