The 5-Pyrimidinamine,2,4-dichloro-6-methyl-, with the CAS registry number 13162-27-1, has the systematic name of 2,4-dichloro-6-methyl-pyrimidin-5-amine. It belongs to the product categories of Building Blocks;Pyrimidine. And the molecular formula of this chemical is C5H5Cl2N3.
The physical properties of 5-Pyrimidinamine,2,4-dichloro-6-methyl- are as followings: (1)ACD/LogP: 0.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.71; (4)ACD/LogD (pH 7.4): 0.71; (5)#H bond acceptors: 3; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 51.8 Å2; (9)Index of Refraction: 1.614; (10)Molar Refractivity: 41.28 cm3; (11)Molar Volume: 118.3 cm3; (12)Polarizability: 16.36×10-24cm3; (13)Surface Tension: 61 dyne/cm; (14)Density: 1.504 g/cm3; (15)Flash Point: 124.1 °C; (16)Enthalpy of Vaporization: 52.04 kJ/mol; (17)Boiling Point: 281.6 °C at 760 mmHg; (18)Vapour Pressure: 0.00353 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Nc1c(Cl)nc(Cl)nc1C
(2)InChI: InChI=1/C5H5Cl2N3/c1-2-3(8)4(6)10-5(7)9-2/h8H2,1H3
(3)InChIKey: FDMMHWIFYCXEOF-UHFFFAOYAT
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