Home Nitros Methyl 2-(5-nitropyridin-2-yl)acetate

Methyl 2-(5-nitropyridin-2-yl)acetate

CAS No.:
292600-22-7
Catalog Number:
AG002XUQ
Molecular Formula:
C8H8N2O4
Molecular Weight:
196.1601
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Product Description
Catalog Number:
AG002XUQ
Chemical Name:
Methyl 2-(5-nitropyridin-2-yl)acetate
CAS Number:
292600-22-7
Molecular Formula:
C8H8N2O4
Molecular Weight:
196.1601
MDL Number:
MFCD15526724
IUPAC Name:
methyl 2-(5-nitropyridin-2-yl)acetate
InChI:
InChI=1S/C8H8N2O4/c1-14-8(11)4-6-2-3-7(5-9-6)10(12)13/h2-3,5H,4H2,1H3
InChI Key:
HWAYALCUMDVEIK-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1ccc(cn1)[N+](=O)[O-]
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.048g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.162g/mol
Monoisotopic Mass:
196.048g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties