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1003711-16-7 | 2-Pyridinamine, 5-methoxy-4-methyl-3-nitro-
CAS No: 1003711-16-7 Catalog No: AG0001SR MDL No:
Product Description
Catalog Number:
AG0001SR
Chemical Name:
2-Pyridinamine, 5-methoxy-4-methyl-3-nitro-
CAS Number:
1003711-16-7
Molecular Formula:
C7H9N3O3
Molecular Weight:
183.1647
IUPAC Name:
5-methoxy-4-methyl-3-nitropyridin-2-amine
InChI:
InChI=1S/C7H9N3O3/c1-4-5(13-2)3-9-7(8)6(4)10(11)12/h3H,1-2H3,(H2,8,9)
InChI Key:
PWEHVPRCSVBVTK-UHFFFAOYSA-N
SMILES:
COc1cnc(c(c1C)[N+](=O)[O-])N
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.064g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.167g/mol
Monoisotopic Mass:
183.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
94A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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