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1000343-76-9 | 2-Pyridinamine, 3-iodo-6-methyl-5-nitro-
CAS No: 1000343-76-9 Catalog No: AG0000MF MDL No:
Product Description
Catalog Number:
AG0000MF
Chemical Name:
2-Pyridinamine, 3-iodo-6-methyl-5-nitro-
CAS Number:
1000343-76-9
Molecular Formula:
C6H6IN3O2
Molecular Weight:
279.0352
IUPAC Name:
3-iodo-6-methyl-5-nitropyridin-2-amine
InChI:
InChI=1S/C6H6IN3O2/c1-3-5(10(11)12)2-4(7)6(8)9-3/h2H,1H3,(H2,8,9)
InChI Key:
RYVJHBZIFBAFRX-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(I)c(nc1C)N
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.95g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.037g/mol
Monoisotopic Mass:
278.95g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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