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Home Boronic acids 4-Nitrophenylboronic acid, pinacol ester

4-Nitrophenylboronic acid, pinacol ester

CAS No.:
171364-83-3
Catalog Number:
AG00HZJE
Molecular Formula:
C12H16BNO4
Molecular Weight:
249.0707
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
95%
In Stock USA
United States
$50
- +
10g
98%
In Stock USA
United States
$94
- +
25g
98%
In Stock USA
United States
$188
- +
100g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG00HZJE
Chemical Name:
4-Nitrophenylboronic acid, pinacol ester
CAS Number:
171364-83-3
Molecular Formula:
C12H16BNO4
Molecular Weight:
249.0707
MDL Number:
MFCD02179437
IUPAC Name:
4,4,5,5-tetramethyl-2-(4-nitrophenyl)-1,3,2-dioxaborolane
InChI:
InChI=1S/C12H16BNO4/c1-11(2)12(3,4)18-13(17-11)9-5-7-10(8-6-9)14(15)16/h5-8H,1-4H3
InChI Key:
LUWACRUAJXZANC-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.117g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.073g/mol
Monoisotopic Mass:
249.117g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
A novel pyrimidine derivatives with aryl urea, thiourea and sulfonamide moieties: synthesis, anti-inflammatory and antimicrobial evaluation. Bioorganic & medicinal chemistry letters 20120515
Properties