Home Nitros N-(2-Methoxy-4-nitrophenyl)-3-oxobutanamide

N-(2-Methoxy-4-nitrophenyl)-3-oxobutanamide

CAS No.:
91088-39-0
Catalog Number:
AG00GVJZ
Molecular Formula:
C11H12N2O5
Molecular Weight:
252.2234
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG00GVJZ
Chemical Name:
N-(2-Methoxy-4-nitrophenyl)-3-oxobutanamide
CAS Number:
91088-39-0
Molecular Formula:
C11H12N2O5
Molecular Weight:
252.2234
MDL Number:
MFCD01610158
IUPAC Name:
N-(2-methoxy-4-nitrophenyl)-3-oxobutanamide
InChI:
InChI=1S/C11H12N2O5/c1-7(14)5-11(15)12-9-4-3-8(13(16)17)6-10(9)18-2/h3-4,6H,5H2,1-2H3,(H,12,15)
InChI Key:
AWRWFTFHIONLAG-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1NC(=O)CC(=O)C)[N+](=O)[O-]
Properties
Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.075g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
252.226g/mol
Monoisotopic Mass:
252.075g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties