Benzenecarboximidamide,3,4-dimethyl- (26130-47-2)

The 3,4-Dimethylbenzamidine, with the cas registry number 26130-47-2, is also known as 3,4-Dimethylbenzenecarboximidamide and Benzamidine,3,4-dimethyl- (8CI). This chemical's molecular formula is C₉H₁₂N₂ and formula weight is 148.2. What's more, its systematic name is called 3,4-Dimethylbenzenecarboximidamide.

Physical properties about this chemical are: (1)ACD/LogP: 1.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.43; (4)ACD/LogD (pH 7.4): -0.43; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.7; (8)ACD/KOC (pH 7.4): 1.71; (9)#H bond acceptors: 2; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 15.6 Å²; (13)Index of Refraction: 1.552; (14)Molar Refractivity: 44.92 cm³; (15)Molar Volume: 140.6 cm³; (16)Surface Tension: 36.8 dyne/cm; (17)Density: 1.05 g/cm³; (18)Flash Point: 109.6 °C; (19)Enthalpy of Vaporization: 49.51 kJ/mol; (20)Boiling Point: 257.5 °C at 760 mmHg; (21)Vapour Pressure: 0.0145 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: [N@H]=C(c1cc(c(cc1)C)C)N
(2)InChI: InChI=1/C9H12N2/c1-6-3-4-8(9(10)11)5-7(6)2/h3-5H,1-2H3,(H3,10,11)
(3)InChIKey: QQSRGYGYLVLMFU-UHFFFAOYAG