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Home > Boronic Acids > 1333387-98-6
1333387-98-6 | (5-fluoro-2-((4-Methylpiperazin-1-yl)Methyl)phenyl)boronic acid
CAS No: 1333387-98-6 Catalog No: AG009YG4 MDL No:MFCD16198077
Product Description
Catalog Number:
AG009YG4
Chemical Name:
(5-fluoro-2-((4-Methylpiperazin-1-yl)Methyl)phenyl)boronic acid
CAS Number:
1333387-98-6
MDL Number:
MFCD16198077
IUPAC Name:
[5-fluoro-2-[(4-methylpiperazin-1-yl)methyl]phenyl]boronic acid
InChI:
InChI=1S/C12H18BFN2O2/c1-15-4-6-16(7-5-15)9-10-2-3-11(14)8-12(10)13(17)18/h2-3,8,17-18H,4-7,9H2,1H3
InChI Key:
QLZHNIJIWSSQDC-UHFFFAOYSA-N
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.145g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
252.096g/mol
Monoisotopic Mass:
252.145g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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