Octanedioic acid,1,8-bis(2,5-dioxo-1-pyrrolidinyl) ester (68528-80-3)

The Disuccinimidyl suberate is an organic compound with the formula C₁₆H₂₀N₂O₈. The IUPAC name of this chemical is bis(2,5-dioxopyrrolidin-1-yl) octanedioate. With the CAS registry number 68528-80-3, it is also named as 1,1'-((1,8-Dioxo-1,8-octanediyl)bis(oxy))bis-2,5-pyrrolidinedione. Besides, it should be stored in a cool, dry place at temperature of 2 - 8 °C.

Physical properties about Disuccinimidyl suberate are: (1)ACD/LogP: -2.24; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -2.24; (4)ACD/LogD (pH 7.4): -2.24; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.44; (8)ACD/KOC (pH 7.4): 1.44; (9)#H bond acceptors: 10; (10)#Freely Rotating Bonds: 11; (11)Polar Surface Area: 127.36 Å²; (12)Index of Refraction: 1.555; (13)Molar Refractivity: 83.99 cm³; (14)Molar Volume: 261.5 cm³; (15)Polarizability: 33.29×10^-24cm³; (16)Surface Tension: 62.8 dyne/cm; (17)Density: 1.4 g/cm³; (18)Flash Point: 264.4 °C; (19)Enthalpy of Vaporization: 78.5 kJ/mol; (20)Boiling Point: 513.5 °C at 760 mmHg; (21)Vapour Pressure: 1.17E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2N(OC(=O)CCCCCCC(=O)ON1C(=O)CCC1=O)C(=O)CC2
(2)InChI: InChI=1/C16H20N2O8/c19-11-7-8-12(20)17(11)25-15(23)5-3-1-2-4-6-16(24)26-18-13(21)9-10-14(18)22/h1-10H2
(3)InChIKey: ZWIBGKZDAWNIFC-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C16H20N2O8/c19-11-7-8-12(20)17(11)25-15(23)5-3-1-2-4-6-16(24)26-18-13(21)9-10-14(18)22/h1-10H2
(5)Std. InChIKey: ZWIBGKZDAWNIFC-UHFFFAOYSA-N