Home Boronic acids 3-BOC-amino-5-nitrophenylboronic acid, pinacol ester

3-BOC-amino-5-nitrophenylboronic acid, pinacol ester

CAS No.:
374595-05-8
Catalog Number:
AG00BY0O
Molecular Formula:
C17H25BN2O6
Molecular Weight:
364.2012
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$275
- +
1g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG00BY0O
Chemical Name:
3-BOC-amino-5-nitrophenylboronic acid, pinacol ester
CAS Number:
374595-05-8
Molecular Formula:
C17H25BN2O6
Molecular Weight:
364.2012
MDL Number:
MFCD03411931
IUPAC Name:
tert-butyl N-[3-nitro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate
InChI:
InChI=1S/C17H25BN2O6/c1-15(2,3)24-14(21)19-12-8-11(9-13(10-12)20(22)23)18-25-16(4,5)17(6,7)26-18/h8-10H,1-7H3,(H,19,21)
InChI Key:
NZVDLOQTDZZSFL-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1cc(cc(c1)[N+](=O)[O-])B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
538  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
364.181g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
364.205g/mol
Monoisotopic Mass:
364.181g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties