Home Boronic acids 3-Butanoyl-4-fluorophenylboronic acid

3-Butanoyl-4-fluorophenylboronic acid

CAS No.:
2096332-56-6
Catalog Number:
AG01EHOQ
Molecular Formula:
C10H12BFO3
Molecular Weight:
210.0099
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$150
- +
5g
96%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG01EHOQ
Chemical Name:
3-Butanoyl-4-fluorophenylboronic acid
CAS Number:
2096332-56-6
Molecular Formula:
C10H12BFO3
Molecular Weight:
210.0099
MDL Number:
MFCD19237170
IUPAC Name:
(3-butanoyl-4-fluorophenyl)boronic acid
InChI:
InChI=1S/C10H12BFO3/c1-2-3-10(13)8-6-7(11(14)15)4-5-9(8)12/h4-6,14-15H,2-3H2,1H3
InChI Key:
VRKNUQIMTSFYAR-UHFFFAOYSA-N
SMILES:
CCCC(=O)c1cc(ccc1F)B(O)O
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.086g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
210.011g/mol
Monoisotopic Mass:
210.086g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties