Magnesium,bis[mono[(4-nitrophenyl)methyl] propanedioato-kO1',kO3]-, (T-4)- (9CI)

The Magnesium mono-p-nitrobenzyl malonate, also known as Magnesium (T-4)-propanedioato]-bis[mono[(4-nitrophenyl)methyl], is an organic compound with the formula C₂₀H₁₆MgN₂O₁₂. Its EINECS registry number is 281-602-2. With the CAS registry number 83972-01-4, its systematic name is magnesium bis{3-[(4-nitrobenzyl)oxy]-3-oxopropanoate}.

Physical properties of Magnesium mono-p-nitrobenzyl malonate: (1)ACD/LogP: 1.30; (2)ACD/LogD (pH 5.5): -2; (3)ACD/LogD (pH 7.4): -2; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 7; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 6; (11)Flash Point: 229.5 °C; (12)Enthalpy of Vaporization: 75.41 kJ/mol; (13)Boiling Point: 455.8 °C at 760 mmHg; (14)Vapour Pressure: 4.22E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [Mg+2].[O-]C(=O)CC(=O)OCc1ccc([N+]([O-])=O)cc1.[O-]C(=O)CC(=O)OCc1ccc(cc1)[N+]([O-])=O
(2)InChI: InChI=1/2C10H9NO6.Mg/c2*12-9(13)5-10(14)17-6-7-1-3-8(4-2-7)11(15)16;/h2*1-4H,5-6H2,(H,12,13);/q;;+2/p-2
(3)InChIKey: WAFDWKYNSTVECG-NUQVWONBAM