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CAS No.: | 1132-19-0 |
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Name: | 4-ETHOXY-BENZENESULFONAMIDE |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C8H11NO3S |
Molecular Weight: | 201.246 |
Synonyms: | Benzenesulfonamide,p-ethoxy- (6CI,7CI,8CI);4-Ethoxybenzenesulfonamide;p-Ethoxybenzenesulfonamide; |
Density: | 1.266 g/cm3 |
Boiling Point: | 360.9 °C at 760 mmHg |
Flash Point: | 172.1 °C |
PSA: | 77.77000 |
LogP: | 2.51380 |
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The Benzenesulfonamide, 4-ethoxy-, with the CAS registry number 1132-19-0, is also known as 4-Ethoxy-benzenesulfonamide. This chemical's molecular formula is C8H11NO3S and molecular weight is 201.2428. What's more, its IUPAC name is 4-Ethoxybenzenesulfonamide.
Physical properties about Benzenesulfonamide, 4-ethoxy- are: (1)ACD/LogP: 1.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 3.4; (6)ACD/BCF (pH 7.4): 3.39; (7)ACD/KOC (pH 5.5): 83.51; (8)ACD/KOC (pH 7.4): 83.4; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 54.99 Å2; (13)Index of Refraction: 1.544; (14)Molar Refractivity: 50.18 cm3; (15)Molar Volume: 158.8 cm3; (16)Polarizability: 19.89×10-24 cm3; (17)Surface Tension: 45 dyne/cm; (18)Density: 1.266 g/cm3; (19)Flash Point: 172.1 °C; (20)Enthalpy of Vaporization: 60.67 kJ/mol; (21)Boiling Point: 360.9 °C at 760 mmHg; (22)Vapour Pressure: 2.15E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=S(=O)(c1ccc(OCC)cc1)N
(2) InChI: InChI=1/C8H11NO3S/c1-2-12-7-3-5-8(6-4-7)13(9,10)11/h3-6H,2H2,1H3,(H2,9,10,11)
(3) InChIKey: ILKGEOVHANZEFC-UHFFFAOYAP