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Home Boronic acids 2-Cyano-6-fluorophenylboronic acid

2-Cyano-6-fluorophenylboronic acid

CAS No.:
656235-44-8
Catalog Number:
AG0036X3
Molecular Formula:
C7H5BFNO2
Molecular Weight:
164.9295
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$75
- +
1g
98%
In Stock USA
United States
$169
- +
5g
98%
In Stock USA
United States
$544
- +
10g
98%
In Stock USA
United States
$950
- +
Product Description
Catalog Number:
AG0036X3
Chemical Name:
2-Cyano-6-fluorophenylboronic acid
CAS Number:
656235-44-8
Molecular Formula:
C7H5BFNO2
Molecular Weight:
164.9295
MDL Number:
MFCD09033623
IUPAC Name:
(2-cyano-6-fluorophenyl)boronic acid
InChI:
InChI=1S/C7H5BFNO2/c9-6-3-1-2-5(4-10)7(6)8(11)12/h1-3,11-12H
InChI Key:
PPLSIVNRHUSMMC-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1B(O)O)F
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.04g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
164.93g/mol
Monoisotopic Mass:
165.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Facile synthesis of 2-bromo-3-fluorobenzonitrile: an application and study of the halodeboronation of aryl boronic acids. The Journal of organic chemistry 20040123
Properties