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24824-26-8

24824-26-8 | Naphthalene, 2,6-dinitro-

CAS No: 24824-26-8 Catalog No: AG002PKC MDL No:

Product Description

Catalog Number:
AG002PKC
Chemical Name:
Naphthalene, 2,6-dinitro-
CAS Number:
24824-26-8
Molecular Formula:
C10H6N2O4
Molecular Weight:
218.1656
IUPAC Name:
2,6-dinitronaphthalene
InChI:
InChI=1S/C10H6N2O4/c13-11(14)9-3-1-7-5-10(12(15)16)4-2-8(7)6-9/h1-6H
InChI Key:
WKHOVPDKOUCPSY-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)ccc(c2)[N+](=O)[O-]

Properties

Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.033g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.168g/mol
Monoisotopic Mass:
218.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

Literature

Title Journal
Optical spectra of delocalized dinitroaromatic radical anions revisited. Journal of the American Chemical Society 20050803
Intervalence near-IR spectra of delocalized dinitroaromatic radical anions. Journal of the American Chemical Society 20031015

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