Home Boronic acids 3-Cyano-2-fluorophenylboronic acid

3-Cyano-2-fluorophenylboronic acid

CAS No.:
957121-05-0
Catalog Number:
AG00IJE8
Molecular Formula:
C7H5BFNO2
Molecular Weight:
164.9295
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$200
- +
10g
98%
In Stock USA
United States
$350
- +
25g
98%
In Stock USA
United States
$700
- +
Product Description
Catalog Number:
AG00IJE8
Chemical Name:
3-Cyano-2-fluorophenylboronic acid
CAS Number:
957121-05-0
Molecular Formula:
C7H5BFNO2
Molecular Weight:
164.9295
MDL Number:
MFCD07374984
IUPAC Name:
(3-cyano-2-fluorophenyl)boronic acid
InChI:
InChI=1S/C7H5BFNO2/c9-7-5(4-10)2-1-3-6(7)8(11)12/h1-3,11-12H
InChI Key:
HENIWPFEWBREIB-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1F)B(O)O
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
Properties