1(2H)-Pyrimidineacetic acid, 3,4-dihydro-2,4-dioxo-5-fluoro-, hexyl ester

Base Information

• Chemical Name: 1(2H)-Pyrimidineacetic acid, 3,4-dihydro-2,4-dioxo-5-fluoro-, hexyl ester
• CAS No.: 174582-14-0
• Molecular Formula: C12H17FN2O4
• Molecular Weight: 272.2728
• DSSTox Substance ID: DTXSID90169852
• Wikidata: Q83039634

Synonyms:174582-14-0;5-Fluorouracil-1-acetylhexane;1(2H)-Pyrimidineacetic acid, 3,4-dihydro-2,4-dioxo-5-fluoro-, hexyl ester;Hexyl 3,4-dihydro-2,4-dioxo-5-fluoro-1(2H)-pyrimidineacetate;Hexyl 2-(5-fluoro-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)acetate;C12H17FN2O4;DTXSID90169852;C12-H17-F-N2-O4;LS-134571

Chemical Property of 1(2H)-Pyrimidineacetic acid, 3,4-dihydro-2,4-dioxo-5-fluoro-, hexyl ester

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 81.42000
• Density: 1.24g/cm³
• LogP: 1.21150
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 272.11723519
• Heavy Atom Count: 19
• Complexity: 395

Purity/Quality:

5-FLUOROURACIL-1-ACETYLHEXANE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCOC(=O)CN1C=C(C(=O)NC1=O)F

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