6-oxo-4-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)-1H-pyrimidine-5-carboxylic acid

Base Information

• Chemical Name: 6-oxo-4-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)-1H-pyrimidine-5-carboxylic acid
• CAS No.: 170865-76-6
• Molecular Formula: C8H2F8N2O3
• Molecular Weight: 326.10
• Mol file: 170865-76-6.mol

Synonyms:170865-76-6;5-Pyrimidinecarboxylic acid,1,4-dihydro-4-oxo-6-(pentafluoroethyl)-2-(trifluoromethyl)-

Chemical Property of 6-oxo-4-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)-1H-pyrimidine-5-carboxylic acid

Chemical Property:

• Vapor Pressure: 0.0542mmHg at 25°C
• PKA: 2.14±0.50(Predicted)
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 2
• Exact Mass: 325.99376723
• Heavy Atom Count: 21
• Complexity: 557

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1(=C(N=C(NC1=O)C(F)(F)F)C(C(F)(F)F)(F)F)C(=O)O