CarbaMic acid, N-[5-chloro-2-fluoro-3-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl]-, 1,1-diMethylethyl ester
化学名:CarbaMic acid, N-[5-chloro-2-fluoro-3-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl]-, 1,1-diMethylethyl ester
CAS番号.1269440-69-8
英語名:CarbaMic acid, N-[5-chloro-2-fluoro-3-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl]-, 1,1-diMethylethyl ester
CBNumberCB02716174
MFC17H24BClFNO4
MW371.64
MOL File1269440-69-8.mol
CarbaMic acid, N-[5-chloro-2-fluoro-3-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)phenyl]-, 1,1-diMethylethyl ester物理性質
沸点 | 404.9±45.0 °C(Predicted) |
比重(密度) | 1.18±0.1 g/cm3(Predicted) |
酸解離定数(Pka) | 12.21±0.70(Predicted) |
InChI | InChI=1S/C17H24BClFNO4/c1-15(2,3)23-14(22)21-12-9-10(19)8-11(13(12)20)18-24-16(4,5)17(6,7)25-18/h8-9H,1-7H3,(H,21,22) |
InChIKey | CVZYUPSHMKRFAB-UHFFFAOYSA-N |
SMILES | C(OC(C)(C)C)(=O)NC1=CC(Cl)=CC(B2OC(C)(C)C(C)(C)O2)=C1F |