Home Boronic acids 4-Butanoylphenylboronic acid, pinacol ester

4-Butanoylphenylboronic acid, pinacol ester

CAS No.:
2096332-77-1
Catalog Number:
AG01EHMK
Molecular Formula:
C16H23BO3
Molecular Weight:
274.1630
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$400
- +
5g
98%
In Stock USA
United States
$1200
- +
Product Description
Catalog Number:
AG01EHMK
Chemical Name:
4-Butanoylphenylboronic acid, pinacol ester
CAS Number:
2096332-77-1
Molecular Formula:
C16H23BO3
Molecular Weight:
274.1630
MDL Number:
MFCD21332948
IUPAC Name:
1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]butan-1-one
InChI:
InChI=1S/C16H23BO3/c1-6-7-14(18)12-8-10-13(11-9-12)17-19-15(2,3)16(4,5)20-17/h8-11H,6-7H2,1-5H3
InChI Key:
KXACZLKHSCCLGY-UHFFFAOYSA-N
SMILES:
CCCC(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
341  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.174g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.167g/mol
Monoisotopic Mass:
274.174g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties