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Home > Boronic Acids > 2096331-46-1
2096331-46-1 | 5-Bromo-2-fluoro-4-(methoxycarbonyl)phenylboronic acid, pinacol ester
CAS No: 2096331-46-1 Catalog No: AG01EHMF MDL No:MFCD18837629
Product Description
Catalog Number:
AG01EHMF
Chemical Name:
5-Bromo-2-fluoro-4-(methoxycarbonyl)phenylboronic acid, pinacol ester
CAS Number:
2096331-46-1
MDL Number:
MFCD18837629
IUPAC Name:
methyl 2-bromo-5-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
InChI:
InChI=1S/C14H17BBrFO4/c1-13(2)14(3,4)21-15(20-13)9-7-10(16)8(6-11(9)17)12(18)19-5/h6-7H,1-5H3
InChI Key:
TWWOHUUTBVPQQO-UHFFFAOYSA-N
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.039g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
358.998g/mol
Monoisotopic Mass:
358.039g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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