Home Boronic acids 3-[2-(Boc-amino)acetamido]benzeneboronic acid pinacol ester

3-[2-(Boc-amino)acetamido]benzeneboronic acid pinacol ester

CAS No.:
1257651-17-4
Catalog Number:
AG009X22
Molecular Formula:
C19H29BN2O5
Molecular Weight:
376.2550
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$53
- +
1g
95%
In Stock USA
United States
$82
- +
5g
95%
In Stock USA
United States
$320
- +
Product Description
Catalog Number:
AG009X22
Chemical Name:
3-[2-(Boc-amino)acetamido]benzeneboronic acid pinacol ester
CAS Number:
1257651-17-4
Molecular Formula:
C19H29BN2O5
Molecular Weight:
376.2550
MDL Number:
MFCD16294500
IUPAC Name:
tert-butyl N-[2-oxo-2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)anilino]ethyl]carbamate
InChI:
InChI=1S/C19H29BN2O5/c1-17(2,3)25-16(24)21-12-15(23)22-14-10-8-9-13(11-14)20-26-18(4,5)19(6,7)27-20/h8-11H,12H2,1-7H3,(H,21,24)(H,22,23)
InChI Key:
IYTPRTWBNLJZLK-UHFFFAOYSA-N
SMILES:
O=C(Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C)CNC(=O)OC(C)(C)C
Properties
Complexity:
543  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.217g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
376.26g/mol
Monoisotopic Mass:
376.217g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
85.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties