Home Boronic acids 4-Phthalimidomethylphenylboronic acid, pinacol ester

4-Phthalimidomethylphenylboronic acid, pinacol ester

CAS No.:
138500-87-5
Catalog Number:
AG0019BO
Molecular Formula:
C21H22BNO4
Molecular Weight:
363.2147
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$32
- +
5g
95%
In Stock USA
United States
$151
- +
Product Description
Catalog Number:
AG0019BO
Chemical Name:
4-Phthalimidomethylphenylboronic acid, pinacol ester
CAS Number:
138500-87-5
Molecular Formula:
C21H22BNO4
Molecular Weight:
363.2147
MDL Number:
MFCD02179489
IUPAC Name:
2-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]isoindole-1,3-dione
InChI:
InChI=1S/C21H22BNO4/c1-20(2)21(3,4)27-22(26-20)15-11-9-14(10-12-15)13-23-18(24)16-7-5-6-8-17(16)19(23)25/h5-12H,13H2,1-4H3
InChI Key:
ZLSIUDAKDAXZRV-UHFFFAOYSA-N
SMILES:
O=C1N(Cc2ccc(cc2)B2OC(C(O2)(C)C)(C)C)C(=O)c2c1cccc2
Properties
Complexity:
571  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.164g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
363.22g/mol
Monoisotopic Mass:
363.164g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties