4-METHYL-6-(2-THIENYL)-2-PYRIMIDINAMINE

The 2-Pyrimidinamine,4-methyl-6-(2-thienyl)- is an organic compound with the formula C₉H₉N₃S. The IUPAC name of this chemical is 4-Methyl-6-thiophen-2-ylpyrimidin-2-amine. With the CAS registry number 26963-43-9, it is also named as 2-Amino-4-methyl-6-(2-thienyl)pyrimidine. Besides, its molecular weight is 191.25.

The physical properties of 2-Pyrimidinamine,4-methyl-6-(2-thienyl)- are: (1)ACD/LogP: 1.80; (2)ACD/LogD (pH 5.5): 1.78; (3)ACD/LogD (pH 7.4): 1.8; (4)ACD/BCF (pH 5.5): 13.14; (5)ACD/BCF (pH 7.4): 13.78; (6)ACD/KOC (pH 5.5): 217; (7)ACD/KOC (pH 7.4): 227.57; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 57.26 Å²; (12)Index of Refraction: 1.65; (13)Molar Refractivity: 54.47 cm³; (14)Molar Volume: 149.2 cm³; (15)Polarizability: 21.59×10^-24 cm³; (16)Surface Tension: 60.1 dyne/cm; (17)Density: 1.281 g/cm³; (18)Flash Point: 197.4 °C; (19)Enthalpy of Vaporization: 65.39 kJ/mol; (20)Boiling Point: 402.7 °C at 760 mmHg; (21)Vapour Pressure: 1.07E-06 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of 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: n2c(nc(c1sccc1)cc2C)N
(2)InChI: InChI=1/C9H9N3S/c1-6-5-7(12-9(10)11-6)8-3-2-4-13-8/h2-5H,1H3,(H2,10,11,12)
(3)InChIKey: HOVGXOGNNMTUTM-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C9H9N3S/c1-6-5-7(12-9(10)11-6)8-3-2-4-13-8/h2-5H,1H3,(H2,10,11,12)
(5)Std. InChIKey: HOVGXOGNNMTUTM-UHFFFAOYSA-N