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Home > Boronic Acids > 1310949-87-1
1310949-87-1 | 1,3,2-DIOXABOROLANE, 4,4,5,5-TETRAMETHYL-2-[4-(2,2,2-TRIFLUOROETHYL)PHENY+
CAS No: 1310949-87-1 Catalog No: AG01BY8G MDL No:MFCD18734065
Product Description
Catalog Number:
AG01BY8G
Chemical Name:
1,3,2-DIOXABOROLANE, 4,4,5,5-TETRAMETHYL-2-[4-(2,2,2-TRIFLUOROETHYL)PHENY+
CAS Number:
1310949-87-1
Molecular Formula:
C14H18BF3O2
Molecular Weight:
286.0977
MDL Number:
MFCD18734065
IUPAC Name:
4,4,5,5-tetramethyl-2-[4-(2,2,2-trifluoroethyl)phenyl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C14H18BF3O2/c1-12(2)13(3,4)20-15(19-12)11-7-5-10(6-8-11)9-14(16,17)18/h5-8H,9H2,1-4H3
InChI Key:
BBCHOGMROQZLQC-UHFFFAOYSA-N
SMILES:
FC(Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)(F)F
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.135g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.101g/mol
Monoisotopic Mass:
286.135g/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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