942069-53-6
2-(3-BROMO-5-METHYLPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
Name2-(3-BROMO-5-METHYLPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
pro_formulaC13 H18 B Br O2
1Identification
【Name】
2-(3-BROMO-5-METHYLPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
【CAS】
【MDL】
MFCD12405330
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C13 H18 B Br O2
【pro_molWeight】
296.998
【Inchi】
InChI=1S/C13H18BBrO2/c1-9-6-10(8-11(15)7-9)14-16-12(2,3)13(4,5)17-14/h6-8H,1-5H3
【InChIKey】
InChIKey=ULWOHZNOAMCALR-UHFFFAOYSA-N
【SMILES】
B1(OC(C(O1)(C)C)(C)C)c2cc(cc(c2)Br)C
【MOL File】
2-(3-BROMO-5-METHYLP….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:2
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2-(3-BROMO-5-METHYLPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE.cml