Benzenesulfonylchloride, 2-methoxy-4-methyl-

The Benzenesulfonylchloride, 2-methoxy-4-methyl-, with the CAS registry number of 216394-11-5, is also known as Benzenesulfonyl chloride, 2-methoxy-4-methyl- (9CI). It belongs to the product category of Sulfonylhalide. This chemical's molecular formula is C₈H₉ClO₃S and molecular weight is 220.67. What's more, its IUPAC name is 2-Methoxy-4-methylbenzenesulfonyl chloride. In addition, it must be stored in airtight containers and placed in a cool place. Besides, you should ensure the work place is well-ventilated.

Physical properties about the Benzenesulfonylchloride, 2-methoxy-4-methyl- are: (1)ACD/LogP: 2.36; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.36; (4)ACD/LogD (pH 7.4): 2.36; (5)ACD/BCF (pH 5.5): 36.78; (6)ACD/BCF (pH 7.4): 36.78; (7)ACD/KOC (pH 5.5): 459.51; (8)ACD/KOC (pH 7.4): 459.51; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 51.75 Å²; (13)Index of Refraction: 1.529; (14)Molar Refractivity: 51.38 cm³; (15)Molar Volume: 166.3 cm³; (16)Surface Tension: 40.2 dyne/cm; (17)Density: 1.326 g/cm³; (18)Flash Point: 147.3 °C; (19)Enthalpy of Vaporization: 53.92 kJ/mol; (20)Boiling Point: 319.9 °C at 760 mmHg; (21)Vapour Pressure: 0.000614 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it may cause burns. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible). In addition, during using it, wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1) SMILES: ClS(=O)(=O)c1ccc(cc1OC)C
(2) InChI: InChI=1/C8H9ClO3S/c1-6-3-4-8(13(9,10)11)7(5-6)12-2/h3-5H,1-2H3
(3) InChIKey: BEDNMYGUVYQPTP-UHFFFAOYAU