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Home > Nitro Compounds > 70938-75-9
70938-75-9 | Pyridine, 2-[(2,4-dinitrophenyl)methylene]-1,2-dihydro-
CAS No: 70938-75-9 Catalog No: AG005Q45 MDL No:
Product Description
Catalog Number:
AG005Q45
Chemical Name:
Pyridine, 2-[(2,4-dinitrophenyl)methylene]-1,2-dihydro-
CAS Number:
70938-75-9
Molecular Formula:
C12H9N3O4
Molecular Weight:
259.2176
IUPAC Name:
2-[(2,4-dinitrophenyl)methylidene]-1H-pyridine
InChI:
InChI=1S/C12H9N3O4/c16-14(17)11-5-4-9(12(8-11)15(18)19)7-10-3-1-2-6-13-10/h1-8,13H
InChI Key:
IGTYXPNPCNNHAH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1C=c1cccc[nH]1)[N+](=O)[O-]
Properties
Complexity:
459
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.059g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
259.221g/mol
Monoisotopic Mass:
259.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.9
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