The 2,3,6-Trichlorobenzoic acid, with the CAS registry number 50-31-7, is also known as Benzoic acid, 2,3,6-trichloro-. It belongs to the product categories of Aromatic Acid; Alphabetic; Herbicides; Pesticides & Metabolites; TP - TZ. Its EINECS registry number is 200-026-4. This chemical's molecular formula is C₇H₃Cl₃O₂ and molecular weight is 225.46. What's more, its IUPAC name is the same with its product name.

Physical properties about 2,3,6-Trichlorobenzoic acid are: (1)ACD/LogP: 3.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.11; (4)ACD/LogD (pH 7.4): -0.14; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.611; (14)Molar Refractivity: 47.86 cm³; (15)Molar Volume: 137.8 cm³; (16)Surface Tension: 56 dyne/cm; (17)Density: 1.635 g/cm³; (18)Flash Point: 150.1 °C; (19)Enthalpy of Vaporization: 59.81 kJ/mol; (20)Boiling Point: 324.5 °C at 760 mmHg; (21)Vapour Pressure: 9.98E-05 mmHg at 25 °C.

Preparation of 2,3,6-Trichlorobenzoic acid: this chemical can be prepared by 2,3,6-Trichloro-toluene. This reaction needs reagent O₂ and solvent acetic acid at temperature of 105 °C. The reaction time is 6 hours. The yield is 97.4 %.

When you are dealing with this chemical, you should be very careful. This chemical may cause damage to health and may present an immediate or delayed danger to one or more components of the environment. It is harmful if swallowed and it is toxic to aquatic organisms. Therefore, you should avoid releasing to the environment and refer to special instructions/safety data sheet.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1c(C(=O)O)c(Cl)ccc1Cl
(2) InChI: InChI=1S/C7H3Cl3O2/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2H,(H,11,12)
(3) InChIKey: XZIDTOHMJBOSOX-UHFFFAOYSA-N

The toxicity data is as follows: