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102627-63-4 | 2-Pyridinamine, N-ethyl-4-methyl-N,5-dinitro-
CAS No: 102627-63-4 Catalog No: AG0007ZF MDL No:
Product Description
Catalog Number:
AG0007ZF
Chemical Name:
2-Pyridinamine, N-ethyl-4-methyl-N,5-dinitro-
CAS Number:
102627-63-4
Molecular Formula:
C8H10N4O4
Molecular Weight:
226.1894
IUPAC Name:
N-ethyl-N-(4-methyl-5-nitropyridin-2-yl)nitramide
InChI:
InChI=1S/C8H10N4O4/c1-3-10(12(15)16)8-4-6(2)7(5-9-8)11(13)14/h4-5H,3H2,1-2H3
InChI Key:
QNFCBMNZOVZPGY-UHFFFAOYSA-N
SMILES:
CCN(c1ncc(c(c1)C)[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.07g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.192g/mol
Monoisotopic Mass:
226.07g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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