9,10-DIAMINOPHENANTHRENE

The 9,10-Phenanthrenediamine, with CAS registry number 53348-04-2, has the systematic name of phenanthrene-9,10-diamine. Besides this, it is also called 9,10-Diaminophenanthrene. And the chemical formula of this chemical is C₁₄H₁₂N₂. What's more, its EINECS is 258-490-9.

Physical properties of 9,10-Phenanthrenediamine: (1)ACD/LogP: 2.51; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.44; (4)ACD/LogD (pH 7.4): 2.51; (5)ACD/BCF (pH 5.5): 40.5; (6)ACD/BCF (pH 7.4): 47.81; (7)ACD/KOC (pH 5.5): 469.27; (8)ACD/KOC (pH 7.4): 554.06; (9)#H bond acceptors: 2; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 6.48 Å²; (13)Index of Refraction: 1.816; (14)Molar Refractivity: 70.41 cm³; (15)Molar Volume: 162.2 cm³; (16)Polarizability: 27.91×10^-24cm³; (17)Surface Tension: 68.4 dyne/cm; (18)Density: 1.283 g/cm³; (19)Flash Point: 276.6 °C; (20)Enthalpy of Vaporization: 71.77 kJ/mol; (21)Boiling Point: 457.6 °C at 760 mmHg; (22)Vapour Pressure: 1.47E-08 mmHg at 25°C.

Uses of 9,10-Phenanthrenediamine: it can be used to produce 2,3-bis-trifluoromethyl-dibenzo[f,h]quinoxaline. This reaction will need reagent dimethylformamide. The reaction time is 3 hour(s) with reaction temperature of 50 ℃. The yield is about 57%.

When you are using this chemical, please be cautious about it as the following:
The 9,10-Phenanthrenediamine irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: c23c1ccccc1c(N)c(N)c2cccc3
(2)InChI: InChI=1/C14H12N2/c15-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14(13)16/h1-8H,15-16H2
(3)InChIKey: VPRFQZSTJXHBHL-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C14H12N2/c15-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14(13)16/h1-8H,15-16H2
(5)Std. InChIKey: VPRFQZSTJXHBHL-UHFFFAOYSA-N