Home Nitros 2-Methoxyethyl 2-(3-nitrobenzylidene)acetoacetate

2-Methoxyethyl 2-(3-nitrobenzylidene)acetoacetate

CAS No.:
39562-22-6
Catalog Number:
AG00I7S7
Molecular Formula:
C14H15NO6
Molecular Weight:
293.2720
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
98%
In Stock USA
United States
$60
- +
500mg
98%
In Stock USA
United States
$123
- +
1g
98%
In Stock USA
United States
$172
- +
5g
98%
In Stock USA
United States
$630
- +
10g
98%
In Stock USA
United States
$1241
- +
Product Description
Catalog Number:
AG00I7S7
Chemical Name:
2-Methoxyethyl 2-(3-nitrobenzylidene)acetoacetate
CAS Number:
39562-22-6
Molecular Formula:
C14H15NO6
Molecular Weight:
293.2720
MDL Number:
MFCD00521048
IUPAC Name:
2-methoxyethyl (2E)-2-[(3-nitrophenyl)methylidene]-3-oxobutanoate
InChI:
InChI=1S/C14H15NO6/c1-10(16)13(14(17)21-7-6-20-2)9-11-4-3-5-12(8-11)15(18)19/h3-5,8-9H,6-7H2,1-2H3/b13-9+
InChI Key:
UVZJPCAZMGLNTB-UKTHLTGXSA-N
SMILES:
COCCOC(=O)/C(=C/c1cccc(c1)[N+](=O)[O-])/C(=O)C
EC Number:
254-511-0
Properties
Complexity:
426  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
293.09g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.275g/mol
Monoisotopic Mass:
293.09g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
98.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties