Home Boronic acids 4-(N-Propylaminocarbonylmethyl)phenylboronic acid

4-(N-Propylaminocarbonylmethyl)phenylboronic acid

CAS No.:
1256345-81-9
Catalog Number:
AG000O0Y
Molecular Formula:
C11H16BNO3
Molecular Weight:
221.0606
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$250
- +
5g
96%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG000O0Y
Chemical Name:
4-(N-Propylaminocarbonylmethyl)phenylboronic acid
CAS Number:
1256345-81-9
Molecular Formula:
C11H16BNO3
Molecular Weight:
221.0606
MDL Number:
MFCD17015734
IUPAC Name:
[4-[2-oxo-2-(propylamino)ethyl]phenyl]boronic acid
InChI:
InChI=1S/C11H16BNO3/c1-2-7-13-11(14)8-9-3-5-10(6-4-9)12(15)16/h3-6,15-16H,2,7-8H2,1H3,(H,13,14)
InChI Key:
OVUKJQVGEINYRX-UHFFFAOYSA-N
SMILES:
CCCNC(=O)Cc1ccc(cc1)B(O)O
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.122g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
221.063g/mol
Monoisotopic Mass:
221.122g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties