3,5-DIMETHOXYBENZOYL CHLORIDE

The Benzoyl chloride,3,5-dimethoxy-, with the CAS registry number 17213-57-9, is also known as 3,5-Dimethoxybenzoic acid chloride. It belongs to the product categories of Aromatic Halides (Substituted); Building Blocks for Dendrimers; Functional Materials; Acid Halides; Carbonyl Compounds; Organic Building Blocks. Its EINECS registry number is 241-256-5. This chemical's molecular formula is C₉H₉ClO₃ and molecular weight is 200.62. What's more, both its IUPAC name and systematic name are the same which is called 3,5-Dimethoxybenzoyl chloride.

Physical properties about Benzoyl chloride,3,5-dimethoxy- are: (1)ACD/LogP: 2.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.42; (4)ACD/LogD (pH 7.4): 2.42; (5)ACD/BCF (pH 5.5): 40.7; (6)ACD/BCF (pH 7.4): 40.7; (7)ACD/KOC (pH 5.5): 494.02; (8)ACD/KOC (pH 7.4): 494.02; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.52; (14)Molar Refractivity: 49.85 cm³; (15)Molar Volume: 163.8 cm³; (16)Surface Tension: 37.1 dyne/cm; (17)Density: 1.224 g/cm³; (18)Flash Point: 131.1 °C; (19)Enthalpy of Vaporization: 52.35 kJ/mol; (20)Boiling Point: 284.5 °C at 760 mmHg; (21)Vapour Pressure: 0.00296 mmHg at 25 °C.

Preparation of Benzoyl chloride,3,5-dimethoxy-: this chemical can be prepared by 3,5-Dimethoxy-benzoic acid. This reaction needs reagent thionyl chloride and solvent benzene at temperature of 80 °C. The reaction time is 3 hours.

Uses of Benzoyl chloride,3,5-dimethoxy-: it is used to produce other chemicals. For example, it is used to produce 3,5-dimethoxy-benzaldehyde. The reaction occurs with reagents palladium-barium sulfate, xylene and other condition of hydrogenation at temperature of 140 °C.

When you are dealing with this chemical, you should be very careful. This chemical may destroy living tissue on contact and may cause burns. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice. And in case of accident or if you feel unwell seek medical advice immediately.

You can still convert the following datas into molecular structure:
(1) SMILES: ClC(=O)c1cc(OC)cc(OC)c1
(2) InChI: InChI=1/C9H9ClO3/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5H,1-2H3
(3) InChIKey: FTHPLWDYWAKYCY-UHFFFAOYAT