2,3-DICHLORO-5-NITRO-BENZOTRIFLUORIDE

The Benzene,1,2-dichloro-5-nitro-3-(trifluoromethyl)-, with the CAS registry number 400-65-7, is also known as 1,2-Dichloro-5-nitro-3-(trifluoromethyl)benzene. This chemical's molecular formula is C₇H₂Cl₂F₃NO₂ and molecular weight is 260.00. What's more, its systematic name is 2,3-diphenyl-1H-indole. Its classification codes are:.

Physical properties of Benzene,1,2-dichloro-5-nitro-3-(trifluoromethyl)- are: (1)ACD/LogP: 4.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.17; (4)ACD/LogD (pH 7.4): 4.17; (5)ACD/BCF (pH 5.5): 869.32; (6)ACD/BCF (pH 7.4): 869.32; (7)ACD/KOC (pH 5.5): 4420.43; (8)ACD/KOC (pH 7.4): 4420.43; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 45.82 Å²; (13)Index of Refraction: 1.511; (14)Molar Refractivity: 47.56 cm³; (15)Molar Volume: 158.6 cm³; (16)Polarizability: 18.85×10^-24cm³; (17)Surface Tension: 37.1 dyne/cm; (18)Density: 1.638 g/cm³; (19)Flash Point: 102.2 °C; (20)Enthalpy of Vaporization: 46.3 kJ/mol; (21)Boiling Point: 245.4 °C at 760 mmHg; (22)Vapour Pressure: 0.0449 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 using it, you need wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1c(cc(cc1Cl)N(=O)=O)C(F)(F)F
(2)Std. InChI: InChI=1S/C7H2Cl2F3NO2/c8-5-2-3(13(14)15)1-4(6(5)9)7(10,11)12/h1-2H
(3)Std. InChIKey: DPOBIBPWXIPEHF-UHFFFAOYSA-N