Home Carboxys ethyl 2-ethyl-5-nitropyridine-3-carboxylate

ethyl 2-ethyl-5-nitropyridine-3-carboxylate

CAS No.:
923145-41-9
Catalog Number:
AG019PUY
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
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Product Description
Catalog Number:
AG019PUY
Chemical Name:
ethyl 2-ethyl-5-nitropyridine-3-carboxylate
CAS Number:
923145-41-9
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
MDL Number:
MFCD08444593
IUPAC Name:
ethyl 2-ethyl-5-nitropyridine-3-carboxylate
InChI:
InChI=1S/C10H12N2O4/c1-3-9-8(10(13)16-4-2)5-7(6-11-9)12(14)15/h5-6H,3-4H2,1-2H3
InChI Key:
FWGSDHOSZRZYHD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(C(=O)OCC)c(nc1)CC
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.08g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.216g/mol
Monoisotopic Mass:
224.08g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties