2,3,6-TRIMETHYLQUINOXALINE

The Quinoxaline,2,3,6-trimethyl-, with the CAS registry number 17635-21-1 and EINECS registry number 241-618-2, has the systematic name and IUPAC name of 2,3,6-trimethylquinoxaline. And the molecular formula of the chemical is C₁₁H₁₂N₂.

The characteristics of Quinoxaline,2,3,6-trimethyl- are as followings: (1)ACD/LogP: 2.68; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.68; (4)ACD/LogD (pH 7.4): 2.68; (5)ACD/BCF (pH 5.5): 63.76; (6)ACD/BCF (pH 7.4): 63.79; (7)ACD/KOC (pH 5.5): 681.2; (8)ACD/KOC (pH 7.4): 681.46; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 25.78 Ų; (13)Index of Refraction: 1.605; (14)Molar Refractivity: 54.75 cm³; (15)Molar Volume: 158.8 cm³; (16)Polarizability: 21.7×10^-24cm³; (17)Surface Tension: 45.4 dyne/cm; (18)Density: 1.084 g/cm³; (19)Flash Point: 113.6 °C; (20)Enthalpy of Vaporization: 49.55 kJ/mol; (21)Boiling Point: 277.7 °C at 760 mmHg; (22)Vapour Pressure: 0.00752 mmHg at 25°C. 

Uses of Quinoxaline,2,3,6-trimethyl-: It can be used to produce 2,3,6-trimethyl-5-quinoxalinol. This reaction will need reagent aq. H₂SO₄. The reaction time is 8 hours, and the yield is about 38%.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: n1c2ccc(cc2nc(c1C)C)C
(2)InChI: InChI=1/C11H12N2/c1-7-4-5-10-11(6-7)13-9(3)8(2)12-10/h4-6H,1-3H3
(3)InChIKey: GQRWKGBOBWHKHP-UHFFFAOYAX