Home Boronic acids 4-Cyano-3,5-difluorophenylboronic acid

4-Cyano-3,5-difluorophenylboronic acid

CAS No.:
861710-03-4
Catalog Number:
AG00H0D7
Molecular Formula:
C7H4BF2NO2
Molecular Weight:
182.9200
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$438
- +
5g
95%
In Stock USA
United States
$1375
- +
Product Description
Catalog Number:
AG00H0D7
Chemical Name:
4-Cyano-3,5-difluorophenylboronic acid
CAS Number:
861710-03-4
Molecular Formula:
C7H4BF2NO2
Molecular Weight:
182.9200
MDL Number:
MFCD07644470
IUPAC Name:
(4-cyano-3,5-difluorophenyl)boronic acid
InChI:
InChI=1S/C7H4BF2NO2/c9-6-1-4(8(12)13)2-7(10)5(6)3-11/h1-2,12-13H
InChI Key:
YKYMGFVDWOIHJH-UHFFFAOYSA-N
SMILES:
N#Cc1c(F)cc(cc1F)B(O)O
Properties
Complexity:
218  
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