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Home > Boronic Acids > 1432571-98-6
1432571-98-6 | 4,4,5,5-Tetramethyl-2-(4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl)-1,3,2-dioxaborolane
CAS No: 1432571-98-6 Catalog No: AG00HWUE MDL No:
Product Description
Catalog Number:
AG00HWUE
Chemical Name:
4,4,5,5-Tetramethyl-2-(4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl)-1,3,2-dioxaborolane
CAS Number:
1432571-98-6
Molecular Formula:
C16H22BF3O2
Molecular Weight:
314.1509
IUPAC Name:
4,4,5,5-tetramethyl-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)phenyl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C16H22BF3O2/c1-13(2,16(18,19)20)11-7-9-12(10-8-11)17-21-14(3,4)15(5,6)22-17/h7-10H,1-6H3
InChI Key:
QUUSYEYDUDIVNW-UHFFFAOYSA-N
SMILES:
CC(C(F)(F)F)(c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
394
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.166g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.155g/mol
Monoisotopic Mass:
314.166g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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