Methyl {[4-tert-butyl-6-(trifluoromethyl)-pyrimidin-2-yl]thio}acetate

Base Information

• Chemical Name: Methyl {[4-tert-butyl-6-(trifluoromethyl)-pyrimidin-2-yl]thio}acetate
• CAS No.: 505054-59-1
• Molecular Formula: C12H15F3N2O2S
• Molecular Weight: 308.32
• DSSTox Substance ID: DTXSID801135941
• Mol file: 505054-59-1.mol

Synonyms:505054-59-1;Methyl {[4-tert-butyl-6-(trifluoromethyl)-pyrimidin-2-yl]thio}acetate;Methyl ([4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]thio)acetate;methyl {[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]thio}acetate;Methyl 2-((4-(tert-butyl)-6-(trifluoromethyl)pyrimidin-2-yl)thio)acetate;methyl 2-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetate;BAS 03153349;DTXSID801135941;HMS1679O09;MFCD02736942;STK341711;AKOS000557774;methyl 2-{[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetate;SB58108;LS-03390;CS-0208364;methyl {[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetate;Methyl2-((4-(tert-butyl)-6-(trifluoromethyl)pyrimidin-2-yl)thio)acetate;Methyl 2-[[4-(1,1-dimethylethyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetate

Chemical Property of Methyl {[4-tert-butyl-6-(trifluoromethyl)-pyrimidin-2-yl]thio}acetate

Chemical Property:

• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 308.08063339
• Heavy Atom Count: 20
• Complexity: 345

Purity/Quality:

98%min ^*data from raw suppliers

Methyl {[4-tert-butyl-6-(trifluoromethyl)-pyrimidin-2-yl]thio}acetate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)C1=CC(=NC(=N1)SCC(=O)OC)C(F)(F)F