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Home > Boronic Acids > 1256781-58-4
1256781-58-4 | 1,3,2-Dioxaborolane, 2-(2-bromo-5-methoxyphenyl)-4,4,5,5-tetramethyl-
CAS No: 1256781-58-4 Catalog No: AG000OBQ MDL No:MFCD17215810
Product Description
Catalog Number:
AG000OBQ
Chemical Name:
1,3,2-Dioxaborolane, 2-(2-bromo-5-methoxyphenyl)-4,4,5,5-tetramethyl-
CAS Number:
1256781-58-4
Molecular Formula:
C13H18BBrO3
Molecular Weight:
312.9952
MDL Number:
MFCD17215810
IUPAC Name:
2-(2-bromo-5-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H18BBrO3/c1-12(2)13(3,4)18-14(17-12)10-8-9(16-5)6-7-11(10)15/h6-8H,1-5H3
InChI Key:
RHHZDWKRQWEDAL-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)B1OC(C(O1)(C)C)(C)C)Br
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.053g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.998g/mol
Monoisotopic Mass:
312.053g/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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