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Home > Boronic Acids > 1186482-12-1
1186482-12-1 | 4,4,5,5-Tetramethyl-2-(4-propoxy-2-(trifluoromethyl)phenyl)-1,3,2-dioxaborolane
CAS No: 1186482-12-1 Catalog No: AG0080ZS MDL No:MFCD18384159
Product Description
Catalog Number:
AG0080ZS
Chemical Name:
4,4,5,5-Tetramethyl-2-(4-propoxy-2-(trifluoromethyl)phenyl)-1,3,2-dioxaborolane
CAS Number:
1186482-12-1
Molecular Formula:
C16H22BF3O3
Molecular Weight:
330.1503
MDL Number:
MFCD18384159
IUPAC Name:
4,4,5,5-tetramethyl-2-[4-propoxy-2-(trifluoromethyl)phenyl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C16H22BF3O3/c1-6-9-21-11-7-8-13(12(10-11)16(18,19)20)17-22-14(2,3)15(4,5)23-17/h7-8,10H,6,9H2,1-5H3
InChI Key:
MUJRSPJLIABSDT-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(c(c1)C(F)(F)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.161g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.154g/mol
Monoisotopic Mass:
330.161g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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