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CAS No.: | 82031-33-2 |
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Name: | 2-(2-Methoxyethoxy)benzenesulfonamide |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C9H13NO4S |
Molecular Weight: | 231.273 |
Synonyms: | 2-(2-Methoxyethoxy)benzenesulfonamide;2-(2-methoxyethoxy)benzenesulfonamide;benzenesulfonamide, 2-(2-methoxyethoxy)-;2-Methoxyethoxybenzene sulfonamide; |
Density: | 1.272 g/cm3 |
Melting Point: | 109-112 °C |
Boiling Point: | 411.9 °C at 760 mmHg |
Flash Point: | 202.9 °C |
PSA: | 87.00000 |
LogP: | 2.14030 |
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The 2-(2-Methoxyethoxy)benzenesulfonamide, with the CAS registry number 82031-33-2, is also called benzenesulfonamide, 2-(2-methoxyethoxy)-. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C9H13NO4S.
The characteristics of 2-(2-Methoxyethoxy)benzenesulfonamide are as followings: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 21.2; (5)ACD/KOC (pH 7.4): 21.15; (6)#H bond acceptors: 5; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 5; (9)Polar Surface Area: 87 Å2; (10)Index of Refraction: 1.534; (11)Molar Refractivity: 56.56 cm3; (12)Molar Volume: 181.7 cm3; (13)Polarizability: 22.42×10-24cm3; (14)Surface Tension: 45.5 dyne/cm; (15)Density: 1.272 g/cm3; (16)Flash Point: 202.9 °C; (17)Enthalpy of Vaporization: 66.44 kJ/mol; (18)Boiling Point: 411.9 °C at 760 mmHg; (19)Vapour Pressure: 5.41E-07 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: NS(=O)(=O)c1ccccc1OCCOC
(2)InChI: InChI=1/C9H13NO4S/c1-13-6-7-14-8-4-2-3-5-9(8)15(10,11)12/h2-5H,6-7H2,1H3,(H2,10,11,12)
(3)InChIKey: UIYMPDRCTPYBLI-UHFFFAOYAG