Home Boronic acids 4-(BOC-Methylamino)phenylboronic acid, pinacol ester

4-(BOC-Methylamino)phenylboronic acid, pinacol ester

CAS No.:
916587-44-5
Catalog Number:
AG006RDE
Molecular Formula:
C18H28BNO4
Molecular Weight:
333.2302
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$63
- +
5g
96%
In Stock USA
United States
$219
- +
Product Description
Catalog Number:
AG006RDE
Chemical Name:
4-(BOC-Methylamino)phenylboronic acid, pinacol ester
CAS Number:
916587-44-5
Molecular Formula:
C18H28BNO4
Molecular Weight:
333.2302
MDL Number:
MFCD03490498
IUPAC Name:
tert-butyl N-methyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate
InChI:
InChI=1S/C18H28BNO4/c1-16(2,3)22-15(21)20(8)14-11-9-13(10-12-14)19-23-17(4,5)18(6,7)24-19/h9-12H,1-8H3
InChI Key:
MWNMXMKLILKYOS-UHFFFAOYSA-N
SMILES:
O=C(N(c1ccc(cc1)B1OC(C(O1)(C)C)(C)C)C)OC(C)(C)C
Properties
Complexity:
448  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.211g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
333.235g/mol
Monoisotopic Mass:
333.211g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
48A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties