2,6-Dichloro-3-methyl-5-nitropyridine (58596-88-6)

The CAS number of the 2,6-Dichloro-3-methyl-5-nitropyridine is 58596-88-6. Its molecular formula is C₆H₄Cl₂N₂O₂. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 2.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 29; (6)ACD/BCF (pH 7.4): 29; (7)ACD/KOC (pH 5.5): 388; (8)ACD/KOC (pH 7.4): 388; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 58.71 Å²; (13)Index of Refraction: 1.591; (14)Molar Refractivity: 45.505 cm³; (15)Molar Volume: 134.675 cm³; (16)Polarizability: 18.039×10^-24cm³; (17)Surface Tension: 54.719 dyne/cm; (18)Enthalpy of Vaporization: 54.3 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(N(=O)=O)c(Cl)nc1Cl
(2)InChI: InChI=1/C6H4Cl2N2O2/c1-3-2-4(10(11)12)6(8)9-5(3)7/h2H,1H3
(3)InChIKey: XLKDPPLSOTVMFR-UHFFFAOYAZ