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Home Boronic acids (2-Fluoro-5-((4-nitrophenyl)carbamoyl)phenyl)boronic acid

(2-Fluoro-5-((4-nitrophenyl)carbamoyl)phenyl)boronic acid

CAS No.:
2096333-41-2
Catalog Number:
AG019EVC
Molecular Formula:
C13H10BFN2O5
Molecular Weight:
304.0383
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$892
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Product Description
Catalog Number:
AG019EVC
Chemical Name:
(2-Fluoro-5-((4-nitrophenyl)carbamoyl)phenyl)boronic acid
CAS Number:
2096333-41-2
Molecular Formula:
C13H10BFN2O5
Molecular Weight:
304.0383
MDL Number:
MFCD20265386
IUPAC Name:
[2-fluoro-5-[(4-nitrophenyl)carbamoyl]phenyl]boronic acid
InChI:
InChI=1S/C13H10BFN2O5/c15-12-6-1-8(7-11(12)14(19)20)13(18)16-9-2-4-10(5-3-9)17(21)22/h1-7,19-20H,(H,16,18)
InChI Key:
YFGKLRLOISCGBR-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(c(c1)B(O)O)F)Nc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
412  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.067g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
304.04g/mol
Monoisotopic Mass:
304.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties