779331-13-4
2-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-4-(TRIFLUOROMETHYL)PHENOL
Name2-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-4-(TRIFLUOROMETHYL)PHENOL
pro_formulaC13 H16 B F3 O3
1Identification
【Name】
2-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-4-(TRIFLUOROMETHYL)PHENOL
【CAS】
【MDL】
MFCD16994239
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C13 H16 B F3 O3
【pro_molWeight】
288.071
【Inchi】
InChI=1S/C13H16BF3O3/c1-11(2)12(3,4)20-14(19-11)9-7-8(13(15,16)17)5-6-10(9)18/h5-7,18H,1-4H3
【InChIKey】
InChIKey=BOSFAXKLICWRSZ-UHFFFAOYSA-N
【SMILES】
B1(OC(C(O1)(C)C)(C)C)c2cc(ccc2O)C(F)(F)F
【MOL File】
2-(4,4,5,5-TETRAMETH….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:3
XLogP3:2.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
2-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-4-(TRIFLUOROMETHYL)PHENOL.cml