Home Boronic acids 2,4-Difluoro-3-cyanophenylboronic acid

2,4-Difluoro-3-cyanophenylboronic acid

CAS No.:
871940-31-7
Catalog Number:
AG008F6E
Molecular Formula:
C7H4BF2NO2
Molecular Weight:
182.9200
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$69
- +
5g
98%
In Stock USA
United States
$259
- +
10g
98%
In Stock USA
United States
$417
- +
25g
98%
In Stock USA
United States
$950
- +
Product Description
Catalog Number:
AG008F6E
Chemical Name:
2,4-Difluoro-3-cyanophenylboronic acid
CAS Number:
871940-31-7
Molecular Formula:
C7H4BF2NO2
Molecular Weight:
182.9200
MDL Number:
MFCD12026699
IUPAC Name:
(3-cyano-2,4-difluorophenyl)boronic acid
InChI:
InChI=1S/C7H4BF2NO2/c9-6-2-1-5(8(12)13)7(10)4(6)3-11/h1-2,12-13H
InChI Key:
VQEKFJVJHSVFTM-UHFFFAOYSA-N
SMILES:
N#Cc1c(F)ccc(c1F)B(O)O
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.03g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
182.921g/mol
Monoisotopic Mass:
183.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties