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The 5-Bromo-6-chloropyridine-3-sulfonyl chloride, with CAS registry number 216394-05-7, belongs to the following product categories: (1)Sulphonyl Chlorides; (2)Pyridine; (3)Aromatics Compounds; (4)Aromatics; (5)Sulfonyl Chlorides; (6)Sulfur & Selenium Compounds. It has the systematic name of 5-bromo-6-chloropyridine-3-sulfonyl chloride. This chemical is a kind of pale yellow solid.
Physical properties of 5-Bromo-6-chloropyridine-3-sulfonyl chloride: (1)ACD/LogP: 2.73; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.73; (4)ACD/LogD (pH 7.4): 2.73; (5)ACD/BCF (pH 5.5): 70.22; (6)ACD/BCF (pH 7.4): 70.22; (7)ACD/KOC (pH 5.5): 730; (8)ACD/KOC (pH 7.4): 730; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 55.41 Å2; (13)Index of Refraction: 1.604; (14)Molar Refractivity: 50.74 cm3; (15)Molar Volume: 147.4 cm3; (16)Polarizability: 20.11×10-24cm3; (17)Surface Tension: 57.4 dyne/cm; (18)Enthalpy of Vaporization: 57.41 kJ/mol; (19)Vapour Pressure: 7.62E-05 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The 5-Bromo-6-chloropyridine-3-sulfonyl chloride may cause burns. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc(cnc1Cl)S(Cl)(=O)=O
(2)InChI: InChI=1/C5H2BrCl2NO2S/c6-4-1-3(12(8,10)11)2-9-5(4)7/h1-2H
(3)InChIKey: TURGMVYIESHZBE-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C5H2BrCl2NO2S/c6-4-1-3(12(8,10)11)2-9-5(4)7/h1-2H
(5)Std. InChIKey: TURGMVYIESHZBE-UHFFFAOYSA-N