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Home Carbonyls Methyl 4-[(ethoxycarbonylmethyl)amino]-3-nitrobenzoate

Methyl 4-[(ethoxycarbonylmethyl)amino]-3-nitrobenzoate

CAS No.:
1381944-43-9
Catalog Number:
AG001871
Molecular Formula:
C12H14N2O6
Molecular Weight:
282.2494
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
10g
98%
In Stock USA
United States
$350
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG001871
Chemical Name:
Methyl 4-[(ethoxycarbonylmethyl)amino]-3-nitrobenzoate
CAS Number:
1381944-43-9
Molecular Formula:
C12H14N2O6
Molecular Weight:
282.2494
MDL Number:
MFCD22375026
IUPAC Name:
methyl 4-[(2-ethoxy-2-oxoethyl)amino]-3-nitrobenzoate
InChI:
InChI=1S/C12H14N2O6/c1-3-20-11(15)7-13-9-5-4-8(12(16)19-2)6-10(9)14(17)18/h4-6,13H,3,7H2,1-2H3
InChI Key:
LHVJHRILVDYQAX-UHFFFAOYSA-N
SMILES:
CCOC(=O)CNc1ccc(cc1[N+](=O)[O-])C(=O)OC
Properties
Complexity:
367  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.085g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
282.252g/mol
Monoisotopic Mass:
282.085g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties