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Home > Boronic Acids > 1073339-12-4
1073339-12-4 | 2-(5-Bromo-2,3-difluorophenyl);-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 1073339-12-4 Catalog No: AG003EXT MDL No:MFCD11855989
Product Description
Catalog Number:
AG003EXT
Chemical Name:
2-(5-Bromo-2,3-difluorophenyl);-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
1073339-12-4
Molecular Formula:
C12H14BBrF2O2
Molecular Weight:
318.9502
MDL Number:
MFCD11855989
IUPAC Name:
2-(5-bromo-2,3-difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C12H14BBrF2O2/c1-11(2)12(3,4)18-13(17-11)8-5-7(14)6-9(15)10(8)16/h5-6H,1-4H3
InChI Key:
PFZXDLSNBLEISL-UHFFFAOYSA-N
SMILES:
Brc1cc(B2OC(C(O2)(C)C)(C)C)c(c(c1)F)F
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.024g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.953g/mol
Monoisotopic Mass:
318.024g/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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