The 2-Chloro-4,6-dimorpholin-4-yl-1,3,5-triazine, also known as NSC56841, is an organic compound with the formula C11H16ClN5O2. With the CAS registry number 7597-22-0, its IUPAC name is 4-(4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine.
Physical properties of 2-Chloro-4,6-dimorpholin-4-yl-1,3,5-triazine: (1)ACD/LogP: 1.23; (2)#H bond acceptors: 7; (3)#Freely Rotating Bonds: 2; (4)Index of Refraction: 1.579; (5)Molar Refractivity: 69.04 cm3; (6)Molar Volume: 207.6 cm3; (7)Surface Tension: 61 dyne/cm; (8)Density: 1.375 g/cm3; (9)Flash Point: 261.2 °C; (10)Enthalpy of Vaporization: 77.86 kJ/mol; (11)Boiling Point: 508.3 °C at 760 mmHg; (12)Vapour Pressure: 1.88E-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1nc(nc(n1)N2CCOCC2)N3CCOCC3
(2)InChI: InChI=1/C11H16ClN5O2/c12-9-13-10(16-1-5-18-6-2-16)15-11(14-9)17-3-7-19-8-4-17/h1-8H2
(3)InChIKey: WYCCBNGHFYBVOM-UHFFFAOYAB
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