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Home > Nitro Compounds > 26149-11-1
26149-11-1 | 2(1H)-Pyridinone, 6-methoxy-3-nitro-
CAS No: 26149-11-1 Catalog No: AG002RUS MDL No:
Product Description
Catalog Number:
AG002RUS
Chemical Name:
2(1H)-Pyridinone, 6-methoxy-3-nitro-
CAS Number:
26149-11-1
Molecular Formula:
C6H6N2O4
Molecular Weight:
170.1228
IUPAC Name:
6-methoxy-3-nitro-1H-pyridin-2-one
InChI:
InChI=1S/C6H6N2O4/c1-12-5-3-2-4(8(10)11)6(9)7-5/h2-3H,1H3,(H,7,9)
InChI Key:
RYLKVLKLMVFOBM-UHFFFAOYSA-N
SMILES:
COc1ccc(c(=O)[nH]1)[N+](=O)[O-]
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.033g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.124g/mol
Monoisotopic Mass:
170.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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