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Home > Boronic Acids > 1449135-58-3
1449135-58-3 | 5-(2-Chloro-5-nitrophenylcarbamoyl)-2-fluorobenzeneboronic acid
CAS No: 1449135-58-3 Catalog No: AG00HXAH MDL No:
Product Description
Catalog Number:
AG00HXAH
Chemical Name:
5-(2-Chloro-5-nitrophenylcarbamoyl)-2-fluorobenzeneboronic acid
CAS Number:
1449135-58-3
IUPAC Name:
[5-[(2-chloro-5-nitrophenyl)carbamoyl]-2-fluorophenyl]boronic acid
InChI:
InChI=1S/C13H9BClFN2O5/c15-10-3-2-8(18(22)23)6-12(10)17-13(19)7-1-4-11(16)9(5-7)14(20)21/h1-6,20-21H,(H,17,19)
InChI Key:
DXESNWXHBVLKNW-UHFFFAOYSA-N
Properties
Complexity:
453
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.028g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
338.482g/mol
Monoisotopic Mass:
338.028g/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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