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Home > Boronic Acids > 1366406-64-5
1366406-64-5 | 2-[4-fluoro-3-(trifluoromethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 1366406-64-5 Catalog No: AG01DVXG MDL No:MFCD18756751
Product Description
Catalog Number:
AG01DVXG
Chemical Name:
2-[4-fluoro-3-(trifluoromethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
1366406-64-5
Molecular Formula:
C13H15BF4O3
Molecular Weight:
306.0610
MDL Number:
MFCD18756751
IUPAC Name:
2-[4-fluoro-3-(trifluoromethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H15BF4O3/c1-11(2)12(3,4)21-14(20-11)8-5-6-9(15)10(7-8)19-13(16,17)18/h5-7H,1-4H3
InChI Key:
TVLVJEMZBKCRRE-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1OC(F)(F)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.105g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.064g/mol
Monoisotopic Mass:
306.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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