Benzenesulfonamide,4-amino-2,5-dimethoxy-N-methyl- (49701-24-8)

The 4-Amino-2,5-dimethoxy-N-methylbenzenesulphonamide, with the CAS registry number 49701-24-8, is also known as N-Methyl-4-amino-2,5-dimethoxybenzenesulfonamide. It belongs to the product category of Intermediates of Dyes and Pigments. Its EINECS registry number is 256-435-3. This chemical's molecular formula is C₉H₁₄N₂O₄S and molecular weight is 246.28. Its IUPAC name which is called 4-amino-2,5-dimethoxy-N-methylbenzenesulfonamide. This chemical is white powder.

Physical properties of 4-Amino-2,5-dimethoxy-N-methylbenzenesulphonamide: (1)ACD/LogP: 0.54; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.53; (4)ACD/LogD (pH 7.4): 0.53; (5)ACD/BCF (pH 5.5): 1.5; (6)ACD/BCF (pH 7.4): 1.5; (7)ACD/KOC (pH 5.5): 46.54; (8)ACD/KOC (pH 7.4): 46.55; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Index of Refraction: 1.545; (13)Molar Refractivity: 60.19 cm³; (14)Molar Volume: 190.3 cm³; (15)Surface Tension: 46.4 dyne/cm; (16)Density: 1.294 g/cm³; (17)Flash Point: 222.4 °C; (18)Enthalpy of Vaporization: 70.18 kJ/mol; (19)Boiling Point: 444.1 °C at 760 mmHg; (20)Vapour Pressure: 4.41E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CNS(=O)(=O)C1=C(C=C(C(=C1)OC)N)OC
(2)InChI: InChI=1S/C9H14N2O4S/c1-11-16(12,13)9-5-7(14-2)6(10)4-8(9)15-3/h4-5,11H,10H2,1-3H3
(3)InChIKey: CISVVDNATRQDNU-UHFFFAOYSA-N