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

4-(3-t-Butyllureido)phenylboronic acid, pinacol ester

CAS No.:
874297-78-6
Catalog Number:
AG004MGQ
Molecular Formula:
C17H27BN2O3
Molecular Weight:
318.2189
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$144
- +
5g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG004MGQ
Chemical Name:
4-(3-t-Butyllureido)phenylboronic acid, pinacol ester
CAS Number:
874297-78-6
Molecular Formula:
C17H27BN2O3
Molecular Weight:
318.2189
MDL Number:
MFCD08689518
IUPAC Name:
1-tert-butyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
InChI:
InChI=1S/C17H27BN2O3/c1-15(2,3)20-14(21)19-13-10-8-12(9-11-13)18-22-16(4,5)17(6,7)23-18/h8-11H,1-7H3,(H2,19,20,21)
InChI Key:
BZMCBGPLSXEWGG-UHFFFAOYSA-N
SMILES:
O=C(NC(C)(C)C)Nc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
422  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.211g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
318.224g/mol
Monoisotopic Mass:
318.211g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties