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Home > Nitro Compounds > 1314960-80-9
1314960-80-9 | N-(6-nitropyridin-2-yl)acetamide
CAS No: 1314960-80-9 Catalog No: AG01D8T7 MDL No:
Product Description
Catalog Number:
AG01D8T7
Chemical Name:
N-(6-nitropyridin-2-yl)acetamide
CAS Number:
1314960-80-9
Molecular Formula:
C7H7N3O3
Molecular Weight:
181.1488
IUPAC Name:
N-(6-nitropyridin-2-yl)acetamide
InChI:
InChI=1S/C7H7N3O3/c1-5(11)8-6-3-2-4-7(9-6)10(12)13/h2-4H,1H3,(H,8,9,11)
InChI Key:
WDPSYOFLOQRVTQ-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cccc(n1)[N+](=O)[O-]
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.049g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.151g/mol
Monoisotopic Mass:
181.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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