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Home > Boronic Acids > 1350451-69-2
1350451-69-2 | (3-Fluoro-4-nitrophenyl)boronic acid
CAS No: 1350451-69-2 Catalog No: AG007LJZ MDL No:MFCD21609542
Product Description
Catalog Number:
AG007LJZ
Chemical Name:
(3-Fluoro-4-nitrophenyl)boronic acid
CAS Number:
1350451-69-2
Molecular Formula:
C6H5BFNO4
Molecular Weight:
184.9176
MDL Number:
MFCD21609542
IUPAC Name:
(3-fluoro-4-nitrophenyl)boronic acid
InChI:
InChI=1S/C6H5BFNO4/c8-5-3-4(7(10)11)1-2-6(5)9(12)13/h1-3,10-11H
InChI Key:
SZTLZSMYZKFFRK-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1)F)[N+](=O)[O-])O
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.03g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
184.917g/mol
Monoisotopic Mass:
185.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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