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Home Nitros Pyridine, 2-[(2,4-dinitrophenyl)methyl]-

Pyridine, 2-[(2,4-dinitrophenyl)methyl]-

CAS No.:
1151-97-9
Catalog Number:
AG000FWG
Molecular Formula:
C12H9N3O4
Molecular Weight:
259.2176
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>98.0%(HPLC)
1 week
United States
$120
- +
5g
>98.0%(HPLC)
1 week
United States
$316
- +
Product Description
Catalog Number:
AG000FWG
Chemical Name:
Pyridine, 2-[(2,4-dinitrophenyl)methyl]-
CAS Number:
1151-97-9
Molecular Formula:
C12H9N3O4
Molecular Weight:
259.2176
MDL Number:
MFCD00014632
IUPAC Name:
2-[(2,4-dinitrophenyl)methyl]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/h1-6,8H,7H2
InChI Key:
KKFNJVINGIUTIH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1Cc1ccccn1)[N+](=O)[O-]
EC Number:
214-567-9
Properties
Complexity:
339  
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:
0
Isotope Atom Count:
0
Molecular Weight:
259.221g/mol
Monoisotopic Mass:
259.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Voronoi-Dirichlet tesselation as a tool for investigation of polymorphism in molecular crystals with CwHxNyOz composition and photochromic properties. Acta crystallographica. Section B, Structural science 20120601
Bis(4-carbamoylpiperidinium) biphenyl-4,4'-disulfonate. Acta crystallographica. Section E, Structure reports online 20101201
2-(2,4-Dinitro-benz-yl)pyridinium 2-hy-droxy-3,5-dinitro-benzoate. Acta crystallographica. Section E, Structure reports online 20100801
4-(4-Nitro-benz-yl)pyridinium 5-nitro-salicylate. Acta crystallographica. Section E, Structure reports online 20100501
Bis[2-(2,4-dinitro-benz-yl)pyridinium] biphenyl-4,4'-disulfonate trihydrate. Acta crystallographica. Section E, Structure reports online 20100501
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Intramolecular nitro-assisted proton transfer in photoirradiated 2-(2',4'-dinitrobenzyl)pyridine: polarized optical spectroscopic study and electronic structure calculations. The journal of physical chemistry. A 20050818
Structure of the photocolored 2-(2',4'-dinitrobenzyl)pyridine crystal: two-photon induced solid-state proton transfer with minor structural perturbation. Journal of the American Chemical Society 20020724
Properties