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Home > Boronic Acids > 1150271-69-4
1150271-69-4 | 1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-[2-methyl-5-[(trifluoromethyl)sulfonyl]phenyl]-
CAS No: 1150271-69-4 Catalog No: AG000FQK MDL No:MFCD12026078
Product Description
Catalog Number:
AG000FQK
Chemical Name:
1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-[2-methyl-5-[(trifluoromethyl)sulfonyl]phenyl]-
CAS Number:
1150271-69-4
Molecular Formula:
C14H18BF3O4S
Molecular Weight:
350.1615
MDL Number:
MFCD12026078
IUPAC Name:
4,4,5,5-tetramethyl-2-[2-methyl-5-(trifluoromethylsulfonyl)phenyl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C14H18BF3O4S/c1-9-6-7-10(23(19,20)14(16,17)18)8-11(9)15-21-12(2,3)13(4,5)22-15/h6-8H,1-5H3
InChI Key:
YCNPSGDEXSAHSO-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1B1OC(C(O1)(C)C)(C)C)S(=O)(=O)C(F)(F)F
Properties
Complexity:
537
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.097g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
350.159g/mol
Monoisotopic Mass:
350.097g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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