2-CHLORO-6-FLUOROBENZYLTHIOL

The Benzenemethanethiol,2-chloro-6-fluoro- is an organic compound with the formula C₇H₆ClFS. The systematic name of this chemical is (2-Chloro-6-fluorophenyl)methanethiol. With the CAS registry number 170924-52-4, it is also named as 2-Chloro-6-fluorobenzyl mercaptan. Besides, its molecular weight is 176.64.

Physical properties about Benzenemethanethiol,2-chloro-6-fluoro- are: (1)ACD/LogP: 2.95; (2)ACD/LogD (pH 5.5): 2.94; (3)ACD/LogD (pH 7.4): 2.93; (4)ACD/BCF (pH 5.5): 101.78; (5)ACD/BCF (pH 7.4): 97.62; (6)ACD/KOC (pH 5.5): 951.97; (7)ACD/KOC (pH 7.4): 913.12; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 25.3 Å²; (10)Index of Refraction: 1.559; (11)Molar Refractivity: 43.95 cm³; (12)Molar Volume: 135.9 cm³; (13)Polarizability: 17.42×10^-24 cm³; (14)Surface Tension: 38.6 dyne/cm; (15)Density: 1.299 g/cm³; (16)Flash Point: 91.6 °C; (17)Enthalpy of Vaporization: 44.55 kJ/mol; (18)Boiling Point: 227.8 °C at 760 mmHg; (19)Vapour Pressure: 0.115 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)InChI: InChI=1/C7H6ClFS/c8-6-2-1-3-7(9)5(6)4-10/h1-3,10H,4H2
(2)InChIKey: TXFPTJWQPHMUEF-UHFFFAOYAS
(3)Std. InChI: InChI=1S/C7H6ClFS/c8-6-2-1-3-7(9)5(6)4-10/h1-3,10H,4H2
(4)Std. InChIKey: TXFPTJWQPHMUEF-UHFFFAOYSA-N