Home Boronic acids 5-Butyryl-2-chlorophenylboronic acid

5-Butyryl-2-chlorophenylboronic acid

CAS No.:
2096330-82-2
Catalog Number:
AG01EHO1
Molecular Formula:
C10H12BClO3
Molecular Weight:
226.4645
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$300
- +
25g
98%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG01EHO1
Chemical Name:
5-Butyryl-2-chlorophenylboronic acid
CAS Number:
2096330-82-2
Molecular Formula:
C10H12BClO3
Molecular Weight:
226.4645
MDL Number:
MFCD18311838
IUPAC Name:
(5-butanoyl-2-chlorophenyl)boronic acid
InChI:
InChI=1S/C10H12BClO3/c1-2-3-10(13)7-4-5-9(12)8(6-7)11(14)15/h4-6,14-15H,2-3H2,1H3
InChI Key:
ZLBSPVXBBYSRJS-UHFFFAOYSA-N
SMILES:
CCCC(=O)c1ccc(c(c1)B(O)O)Cl
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.057g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
226.463g/mol
Monoisotopic Mass:
226.057g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties