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Home > Boronic Acids > 2246545-69-5
2246545-69-5 | 1,3,2-Dioxaborolane, 2-[4-[(4-bromophenoxy)methyl]phenyl]-4,4,5,5-tetramethyl-
CAS No: 2246545-69-5 Catalog No: AG01FFY0 MDL No:
Product Description
Catalog Number:
AG01FFY0
Chemical Name:
1,3,2-Dioxaborolane, 2-[4-[(4-bromophenoxy)methyl]phenyl]-4,4,5,5-tetramethyl-
CAS Number:
2246545-69-5
Molecular Formula:
C19H22BBrO3
Molecular Weight:
389.0912
IUPAC Name:
2-[4-[(4-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)15-7-5-14(6-8-15)13-22-17-11-9-16(21)10-12-17/h5-12H,13H2,1-4H3
InChI Key:
ONPCZFWQFVANAV-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)OCc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
397
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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