509152-20-9
3-BROMO-5-METHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ISOXAZOLE
Name3-BROMO-5-METHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ISOXAZOLE
1Identification
【Name】
3-BROMO-5-METHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ISOXAZOLE
【CAS】
【MDL】
MFCD18383299
【English Synonyms】
【Formula】
C10 H15 B Br N O3
【MolWeight】
287.948
【Inchi】
InChI=1S/C10H15BBrNO3/c1-6-7(8(12)13-14-6)11-15-9(2,3)10(4,5)16-11/h1-5H3
【InChIKey】
InChIKey=LKHGWSYKQJHLBG-UHFFFAOYSA-N
【SMILES】
B1(OC(C(O1)(C)C)(C)C)c2c(onc2Br)C
【MOL File】
3-BROMO-5-METHYL-4-(….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-BROMO-5-METHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ISOXAZOLE.cml