2,5-Dichlorobenzyl alcohol

The Benzenemethanol, 2, 5-dichloro-, with the CAS registry number of 34145-05-6, is also known as 2, 5-Dichlorobenzylic alcohol and (2, 5-Dichloro-phenyl)-methanol. It belongs to the product categories of Benzhydrols, Benzyl & Special Alcohols; Alcohols; C7 to C8; Oxygen Compounds. Its EINECS registry number is 251-850-6. This chemical's molecular formula is C₇H₆Cl₂O and molecular weight is 177.03. What's more, its IUPAC name is (2, 5-Dichlorophenyl)methanol. In addition, it must be stored in airtight containers and placed in a dry, cool place. Meanwhile, it should avoid contact with oxidant. Besides, ensure the work place is well-ventilated.

Physical properties about Benzenemethanol, 2, 5-dichloro- are: (1)ACD/LogP: 2.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.15; (4)ACD/LogD (pH 7.4): 2.15; (5)ACD/BCF (pH 5.5): 25.45; (6)ACD/BCF (pH 7.4): 25.45; (7)ACD/KOC (pH 5.5): 353.03; (8)ACD/KOC (pH 7.4): 353.03; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.582; (14)Molar Refractivity: 42.49 cm³; (15)Molar Volume: 127.1 cm³; (16)Surface Tension: 46.7 dyne/cm; (17)Density: 1.392 g/cm³; (18)Flash Point: 114.3 °C; (19)Enthalpy of Vaporization: 53.2 kJ/mol; (20)Boiling Point: 265.7 °C at 760 mmHg; (21)Vapour Pressure: 0.00452 mmHg at 25 °C.

Uses: it is used to produce other chemicals. For example, it is used to produce 2, 5-Dichloro-benzaldehyde. This reaction will need reagent K₂Cr₂O₇/H₂SO₄ and catalyst Triethylbenzylammonium chloride. Meanwhile, it needs solvents CH₂Cl₂ and H₂O. The reaction time is 4 hours. The yield is about 98 %.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. Hence, you should avoid contacting with skin and eyes.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1ccc(Cl)cc1CO
(2) InChI: InChI=1/C7H6Cl2O/c8-6-1-2-7(9)5(3-6)4-10/h1-3,10H,4H2
(3) InChIKey: LCEIGNVIDJNUGF-UHFFFAOYAC