3,6-Diaminocarbazole CAS NO.86-71-5

1. Introduction of3,6-Diaminocarbazole

3,6-Diaminocarbazole (CAS NO.86-71-5)is one kind of white po…

1. Introduction of 3,6-Diaminocarbazole

3,6-Diaminocarbazole (CAS NO.86-71-5) is one kind of white powder. The IUPAC name of this chemical is 9H-carbazole-3,6-diamine. Besides, 3,6-Diaminocarbazole belongs to Carbazoles; Carbazoles (for Conduting Polymer Research); Functional Materials; Highly Purified Reagents; Other Categories; Reagents for Conducting Polymer Research; Refined Products by Sublimation; Carbazole.

Our 3,6-Diaminocarbazole is on the top purity of 98%～99%. We can produce this chemical 100 Metric Ton per month. It can be packaged in 25kg/plastic drum or 200Kg/iron drum. We will delivery it in two days from the dongguan port by air or by sea. And please store it in sealed storage in shady and cool warehouse in 20 °C. We can accept your Payment Terms such as L/C, D/P, T/T, Westem Unoin, MoneyGram.

2. Basic information of 3,6-Diaminocarbazole
1) Properties of 3,6-Diaminocarbazole

(1)ACD/LogP: 1.16; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 0.9; (4)ACD/LogD (pH 7.4): 1.15; (5)ACD/BCF (pH 5.5): 2.46; (6)ACD/BCF (pH 7.4): 4.41; (7)ACD/KOC (pH 5.5): 55.97; (8)ACD/KOC (pH 7.4): 100.33; (9)#H bond acceptors: 3; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 11.41 Å²; (13)Index of Refraction: 1.889; (14)Molar Refractivity: 64.84 cm³; (15)Molar Volume: 140.5 cm³; (16)Polarizability: 25.7×10^-24cm³; (17)Surface Tension: 84.5 dyne/cm; (18)Density: 1.403 g/cm³; (19)Flash Point: 305.7 °C; (20)Enthalpy of Vaporization: 80.14 kJ/mol; (21)Boiling Point: 526.9 °C at 760 mmHg; (22)Vapour Pressure: 3.42E-11 mmHg at 25°C.

2) The following information could be converted into the structure:

(1)InChI: InChI=1S/C12H11N3/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-6,15H,13-14H2
(2)InChIKey: YCZUWQOJQGCZKG-UHFFFAOYSA-N
(3)Canonical SMILES: C1=CC2=C(C=C1N)C3=C(N2)C=CC(=C3)N
(4)Smiles: [nH]1c2c(cc(N)cc2)c2c1ccc(N)c2

3) Production of 3,6-Diaminocarbazole

3,6-dinitro-carbazole can be used in manufacturing this chemical. This reaction will need reagent H₂ and solvent tetrahydrofuran with the reaction time of 4 days. This reaction needs the catalyst 5% Pd/C. The detailed steps are as follows:



4) Uses of 3,6-Diaminocarbazole

3,6-Diaminocarbazole has the effect of producing 3,6-diphthalimidocarbazole. This reaction needs reagent pyridine with the reaction time of 6 hours. The detailed steps are as follows: