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Home > Nitro Compounds > 192386-09-7
192386-09-7 | Pyridine, 2-[(2,4-dinitrophenyl)methylene]-1,2-dihydro-3-methyl-, (2E)-
CAS No: 192386-09-7 Catalog No: AG002FWP MDL No:
Product Description
Catalog Number:
AG002FWP
Chemical Name:
Pyridine, 2-[(2,4-dinitrophenyl)methylene]-1,2-dihydro-3-methyl-, (2E)-
CAS Number:
192386-09-7
Molecular Formula:
C13H11N3O4
Molecular Weight:
273.2441
IUPAC Name:
2-[(2,4-dinitrophenyl)methylidene]-3-methyl-1H-pyridine
InChI:
InChI=1S/C13H11N3O4/c1-9-3-2-6-14-12(9)7-10-4-5-11(15(17)18)8-13(10)16(19)20/h2-8,14H,1H3
InChI Key:
OLRJWMBWFQQTFH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1/C=c\1/[nH]cccc1C)[N+](=O)[O-]
Properties
Complexity:
499
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.075g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.248g/mol
Monoisotopic Mass:
273.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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