3,4-Dichloro-2-nitro-6-(trifluoromethyl)toluene

The Benzene,1,2-dichloro-4-methyl-3-nitro-5-(trifluoromethyl)-, with CAS registry number 115571-66-9, has the systematic name of 1,2-dichloro-4-methyl-3-nitro-5-(trifluoromethyl)benzene. Besides this, it is also called benzene, 1,2-dichloro-4-methyl-3-nitro-5-(trifluoromethyl)-. And the chemical formula of this chemical is C₈H₄Cl₂F₃NO₂.

Physical properties of Benzene,1,2-dichloro-4-methyl-3-nitro-5-(trifluoromethyl)-: (1)ACD/LogP: 4.30; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 45.82 Å²; (7)Index of Refraction: 1.51; (8)Molar Refractivity: 52.39 cm³; (9)Molar Volume: 174.9 cm³; (10)Polarizability: 20.77×10^-24cm³; (11)Surface Tension: 36.2 dyne/cm; (12)Enthalpy of Vaporization: 47.33 kJ/mol; (13)Vapour Pressure: 0.0257 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Benzene,1,2-dichloro-4-methyl-3-nitro-5-(trifluoromethyl)- irritates to eyes, respiratory system and skin. And this chemical is harmful by inhalation, in contact with skin and if swallowed. When use it, wear suitable protective clothing, gloves and eye/face protection. If 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: Clc1c([N+]([O-])=O)c(c(cc1Cl)C(F)(F)F)C
(2)InChI: InChI=1/C8H4Cl2F3NO2/c1-3-4(8(11,12)13)2-5(9)6(10)7(3)14(15)16/h2H,1H3
(3)InChIKey: IBRWCYHTODRXJR-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C8H4Cl2F3NO2/c1-3-4(8(11,12)13)2-5(9)6(10)7(3)14(15)16/h2H,1H3
(5)Std. InChIKey: IBRWCYHTODRXJR-UHFFFAOYSA-N