245524-93-0 Purity
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Specification
The molecular formula for 3,5-Dinitrosalicylaldehyde is C7H4N2O6.
The molecular weight of 3,5-Dinitrosalicylaldehyde is 212.12 g/mol.
The IUPAC name of 3,5-Dinitrosalicylaldehyde is 2-hydroxy-3,5-dinitrobenzaldehyde.
The InChI of 3,5-Dinitrosalicylaldehyde is InChI=1S/C7H4N2O6/c10-3-4-1-5(8(12)13)2-6(7(4)11)9(14)15/h1-3,11H.
The InChIKey of 3,5-Dinitrosalicylaldehyde is FLJXIBHYDIMYRS-UHFFFAOYSA-N.
The canonical SMILES of 3,5-Dinitrosalicylaldehyde is C1=C(C=C(C(=C1C=O)O)[N+](=O)[O-])[N+](=O)[O-].
The CAS number of 3,5-Dinitrosalicylaldehyde is 2460-59-5.
The XLogP3 value of 3,5-Dinitrosalicylaldehyde is 1.1.
There is 1 hydrogen bond donor in 3,5-Dinitrosalicylaldehyde.
There are 6 hydrogen bond acceptors in 3,5-Dinitrosalicylaldehyde.