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Home > Boronic Acids > 881402-15-9
881402-15-9 | 2-(2,3-Difluoro-4-(trifluoromethyl);phenyl);-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 881402-15-9 Catalog No: AG004DAE MDL No:MFCD18434440
Product Description
Catalog Number:
AG004DAE
Chemical Name:
2-(2,3-Difluoro-4-(trifluoromethyl);phenyl);-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
881402-15-9
Molecular Formula:
C13H14BF5O2
Molecular Weight:
308.0521
MDL Number:
MFCD18434440
IUPAC Name:
2-[2,3-difluoro-4-(trifluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H14BF5O2/c1-11(2)12(3,4)21-14(20-11)8-6-5-7(13(17,18)19)9(15)10(8)16/h5-6H,1-4H3
InChI Key:
WFOAWDLTKGEVOI-UHFFFAOYSA-N
SMILES:
Fc1c(ccc(c1F)C(F)(F)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.101g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.055g/mol
Monoisotopic Mass:
308.101g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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