CAS 1196155-03-9

Carbamic acid, N-[2-methyl-6-(trifluoromethyl)-4-pyrimidinyl]-, 1,1-dimethylethyl ester

Description:

Carbamic acid, N-[2-methyl-6-(trifluoromethyl)-4-pyrimidinyl]-, 1,1-dimethylethyl ester, identified by CAS number 1196155-03-9, is a chemical compound that belongs to the class of carbamates. This substance features a pyrimidine ring substituted with a trifluoromethyl group and a methyl group, contributing to its unique chemical properties. The presence of the carbamate functional group indicates that it may exhibit biological activity, potentially acting as an inhibitor or modulator in various biochemical pathways. The esterification with 1,1-dimethylethyl alcohol suggests that it may have enhanced lipophilicity, which can influence its absorption and distribution in biological systems. Additionally, the trifluoromethyl group is known to enhance metabolic stability and can affect the compound's interaction with biological targets. Overall, this compound's structural characteristics suggest potential applications in pharmaceuticals or agrochemicals, although specific biological activities and applications would require further investigation through empirical studies.

Formula: C₁₁H₁₄F₃N₃O₂

InChI: InChI=1S/C11H14F3N3O2/c1-6-15-7(11(12,13)14)5-8(16-6)17-9(18)19-10(2,3)4/h5H,1-4H3,(H,15,16,17,18)

InChI key: InChIKey=MOKGARDGZTUZPL-UHFFFAOYSA-N

SMILES: N(C(OC(C)(C)C)=O)C=1C=C(C(F)(F)F)N=C(C)N1

Synonyms:

• Carbamic acid, N-[2-methyl-6-(trifluoromethyl)-4-pyrimidinyl]-, 1,1-dimethylethyl ester
• tert-Butyl 2-methyl-6-(trifluoromethyl)pyrimidin-4-ylcarbamate