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Home > Boronic Acids > 2246874-83-7
2246874-83-7 | 2-(4-((3-Bromophenoxy)methyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 2246874-83-7 Catalog No: AG01FKZJ MDL No:
Product Description
Catalog Number:
AG01FKZJ
Chemical Name:
2-(4-((3-Bromophenoxy)methyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
2246874-83-7
Molecular Formula:
C19H22BBrO3
Molecular Weight:
389.0912
IUPAC Name:
2-[4-[(3-bromophenoxy)methyl]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C19H22BBrO3/c1-18(2)19(3,4)24-20(23-18)15-10-8-14(9-11-15)13-22-17-7-5-6-16(21)12-17/h5-12H,13H2,1-4H3
InChI Key:
UPMUUMBCNZWECQ-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)OCc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
388.085g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
389.096g/mol
Monoisotopic Mass:
388.085g/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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