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Home > Boronic Acids > 1449131-84-3
1449131-84-3 | 3-Fluoro-5-(4-fluoro-3-nitrophenylcarbamoyl)benzeneboronic acid
CAS No: 1449131-84-3 Catalog No: AG00HX93 MDL No:
Product Description
Catalog Number:
AG00HX93
Chemical Name:
3-Fluoro-5-(4-fluoro-3-nitrophenylcarbamoyl)benzeneboronic acid
CAS Number:
1449131-84-3
IUPAC Name:
[3-fluoro-5-[(4-fluoro-3-nitrophenyl)carbamoyl]phenyl]boronic acid
InChI:
InChI=1S/C13H9BF2N2O5/c15-9-4-7(3-8(5-9)14(20)21)13(19)17-10-1-2-11(16)12(6-10)18(22)23/h1-6,20-21H,(H,17,19)
InChI Key:
GFDPMXKMWZSRQW-UHFFFAOYSA-N
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.057g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
322.031g/mol
Monoisotopic Mass:
322.057g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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