Home Aminos methyl 2-[(3-nitropyridin-4-yl)amino]acetate

methyl 2-[(3-nitropyridin-4-yl)amino]acetate

CAS No.:
1040313-67-4
Catalog Number:
AG01A5SZ
Molecular Formula:
C8H9N3O4
Molecular Weight:
211.1748
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Product Description
Catalog Number:
AG01A5SZ
Chemical Name:
methyl 2-[(3-nitropyridin-4-yl)amino]acetate
CAS Number:
1040313-67-4
Molecular Formula:
C8H9N3O4
Molecular Weight:
211.1748
MDL Number:
MFCD11184501
IUPAC Name:
methyl 2-[(3-nitropyridin-4-yl)amino]acetate
InChI:
InChI=1S/C8H9N3O4/c1-15-8(12)5-10-6-2-3-9-4-7(6)11(13)14/h2-4H,5H2,1H3,(H,9,10)
InChI Key:
DWPKZJXOWZMHQJ-UHFFFAOYSA-N
SMILES:
COC(=O)CNc1ccncc1[N+](=O)[O-]
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.059g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.177g/mol
Monoisotopic Mass:
211.059g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
97A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties