942070-88-4
4-BROMO-1-METHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE
Name4-BROMO-1-METHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE
FormulaC10 H16 B Br N2 O2
1Identification
【Name】
4-BROMO-1-METHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE
【CAS】
【MDL】
MFCD12405502
【English Synonyms】
【Formula】
C10 H16 B Br N2 O2
【MolWeight】
286.963
【Inchi】
InChI=1S/C10H16BBrN2O2/c1-9(2)10(3,4)16-11(15-9)8-7(12)6-13-14(8)5/h6H,1-5H3
【InChIKey】
InChIKey=WSTPLIAWLPGTLO-UHFFFAOYSA-N
【SMILES】
B1(OC(C(O1)(C)C)(C)C)c2c(cnn2C)Br
【MOL File】
4-BROMO-1-METHYL-5-(….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
4-BROMO-1-METHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE.cml