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Home > Boronic Acids > 1218789-51-5
1218789-51-5 | 1,3,2-Dioxaborolane, 2-[3-bromo-5-[[(1,1-dimethylethyl)dimethylsilyl]oxy]phenyl]-4,4,5,5-tetramethyl-
CAS No: 1218789-51-5 Catalog No: AG00167G MDL No:MFCD12546591
Product Description
Catalog Number:
AG00167G
Chemical Name:
1,3,2-Dioxaborolane, 2-[3-bromo-5-[[(1,1-dimethylethyl)dimethylsilyl]oxy]phenyl]-4,4,5,5-tetramethyl-
CAS Number:
1218789-51-5
Molecular Formula:
C18H30BBrO3Si
Molecular Weight:
413.2295
MDL Number:
MFCD12546591
IUPAC Name:
[3-bromo-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-tert-butyl-dimethylsilane
InChI:
InChI=1S/C18H30BBrO3Si/c1-16(2,3)24(8,9)21-15-11-13(10-14(20)12-15)19-22-17(4,5)18(6,7)23-19/h10-12H,1-9H3
InChI Key:
CXERDKXIELAFHW-UHFFFAOYSA-N
SMILES:
Brc1cc(cc(c1)B1OC(C(O1)(C)C)(C)C)O[Si](C(C)(C)C)(C)C
Properties
Complexity:
446
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
412.124g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
413.234g/mol
Monoisotopic Mass:
412.124g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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