Home Boronic acids 4-(3-Carboxypropanamido)phenylboronic acid, pinacol ester

4-(3-Carboxypropanamido)phenylboronic acid, pinacol ester

CAS No.:
480424-98-4
Catalog Number:
AG00D9UZ
Molecular Formula:
C16H22BNO5
Molecular Weight:
319.1606
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$44
- +
5g
96%
In Stock USA
United States
$132
- +
25g
96%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG00D9UZ
Chemical Name:
4-(3-Carboxypropanamido)phenylboronic acid, pinacol ester
CAS Number:
480424-98-4
Molecular Formula:
C16H22BNO5
Molecular Weight:
319.1606
MDL Number:
MFCD03789267
IUPAC Name:
4-oxo-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)anilino]butanoic acid
InChI:
InChI=1S/C16H22BNO5/c1-15(2)16(3,4)23-17(22-15)11-5-7-12(8-6-11)18-13(19)9-10-14(20)21/h5-8H,9-10H2,1-4H3,(H,18,19)(H,20,21)
InChI Key:
GZCXOZHMQNWRGM-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)CCC(=O)O
Properties
Complexity:
441  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.159g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
319.164g/mol
Monoisotopic Mass:
319.159g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties