4,4'-(1,3-Propanediyl)dioxydianiline

The 4,4'-(1,3-Propanediyl)dioxydianiline, with the CAS registry number 52980-20-8, is also known as Benzenamine, 4-[3-(4-aminophenoxy)propoxy]-. Its molecular formula is C₁₅H₁₈N₂O₂ and its molecular weight is 258.31562. Additionally, its product categories are Amines; Phenyls & Phenyl-Het.

Other characteristics of the 4,4'-(1,3-Propanediyl)dioxydianiline can be summarised as followings: (1)ACD/LogP: 1.48; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.15; (4)ACD/LogD (pH 7.4): 1.47; (5)ACD/BCF (pH 5.5): 3.64; (6)ACD/BCF (pH 7.4): 7.76; (7)ACD/KOC (pH 5.5): 70.45; (8)ACD/KOC (pH 7.4): 150.32; (9)#H bond acceptors: 4; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 24.94 Å²; (13)Index of Refraction: 1.618; (14)Molar Refractivity: 76.91 cm³; (15)Molar Volume: 219.4 cm³; (16)Polarizability: 30.49×10^-24cm³; (17)Surface Tension: 51.3 dyne/cm; (18)Density: 1.177 g/cm³; (19)Flash Point: 259.7 °C; (20)Enthalpy of Vaporization: 72.81 kJ/mol; (21)Boiling Point: 466.4 °C at 760 mmHg; (22)Vapour Pressure: 7.13E-09 mmHg at 25°C.

Production method of the 4,4'-(1,3-Propanediyl)dioxydianiline: It could be obtained by the reactant of 1,3-bis-(4-nitro-phenoxy)-propane. This reaction needs the reagent of H₂, and the catalyst of Pd/C. The yield is 74 %.

Uses of the 4,4'-(1,3-Propanediyl)dioxydianiline: It could react with thiourea to obtain the 1,3-di(thiourea-4-phenoxy)propane. This reaction needs the heating and its yield is 58 %.

You can still convert the following datas into molecular structure: 
1.SMILES: O(c1ccc(cc1)N)CCCOc2ccc(N)cc2
2.InChI: InChI=1/C15H18N2O2/c16-12-2-6-14(7-3-12)18-10-1-11-19-15-8-4-13(17)5-9-15/h2-9H,1,10-11,16-17H2
3.InChIKey: KWFFEQXPFFDJER-UHFFFAOYAE