sales@angenesci.com
Login | Register
logo
Structures Search
Home Boronic acids 4-Ethoxycarbonyl-2-nitrophenylboronic acid

4-Ethoxycarbonyl-2-nitrophenylboronic acid

CAS No.:
5785-70-6
Catalog Number:
AG00IAAP
Molecular Formula:
C9H10BNO6
Molecular Weight:
238.9898
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
98%
In Stock USA
United States
$57
- +
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:
AG00IAAP
Chemical Name:
4-Ethoxycarbonyl-2-nitrophenylboronic acid
CAS Number:
5785-70-6
Molecular Formula:
C9H10BNO6
Molecular Weight:
238.9898
MDL Number:
MFCD02179460
IUPAC Name:
(4-ethoxycarbonyl-2-nitrophenyl)boronic acid
InChI:
InChI=1S/C9H10BNO6/c1-2-17-9(12)6-3-4-7(10(13)14)8(5-6)11(15)16/h3-5,13-14H,2H2,1H3
InChI Key:
GCDAYMSNTGTFDC-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(c(c1)[N+](=O)[O-])B(O)O
Properties
Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.06g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
238.99g/mol
Monoisotopic Mass:
239.06g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
3-Methoxycarbonyl-5-nitrophenyl boronic acid: high affinity diol recognition at neutral pH. Bioorganic & medicinal chemistry letters 20040105
Properties