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Name |
Ethanol,2-[(4-aminophenyl)sulfonyl]- |
EINECS | 226-047-9 |
CAS No. | 5246-58-2 | Density | 1.364 g/cm3 |
PSA | 88.77000 | LogP | 1.69680 |
Solubility | N/A | Melting Point |
210-213 °C (decomp) |
Formula | C8H11NO3S | Boiling Point | 469.2 °C at 760 mmHg |
Molecular Weight | 201.246 | Flash Point | 237.5 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Ethanol,2-sulfanilyl- (6CI,7CI,8CI);2-(4-Aminophenylsulfonyl)ethanol;2-(p-Aminophenylsulfonyl)ethanol;2-Sulfanilylethanol;4-(2-Hydroxyethylsulfonyl)aniline;4-(b-Hydroxyethylsulfonyl)aniline;4-Aminophenyl b-hydroxyethyl sulfone;NSC 82290;p-(2-Hydroxyethylsulfonyl)aniline;p-Aminophenyl 2-hydroxyethyl sulfone; |
Article Data | 6 |
The Ethanol, 2-[(4-aminophenyl)sulfonyl]-, with the CAS registry number 5246-58-2, is also known as 2-((p-Aminophenyl)sulphonyl)ethanol. Its EINECS registry number is 226-047-9. This chemical's molecular formula is C8H11NO3S and molecular weight is 201.24284. What's more, its IUPAC name is 2-(4-Aminophenyl)sulfonylethanol.
Physical properties about Ethanol, 2-[(4-aminophenyl)sulfonyl]- are: (1)ACD/LogP: -0.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.47; (4)ACD/LogD (pH 7.4): -0.47; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 13.28; (8)ACD/KOC (pH 7.4): 13.28; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 54.99 Å2; (13)Index of Refraction: 1.592; (14)Molar Refractivity: 49.98 cm3; (15)Molar Volume: 147.5 cm3; (16)Polarizability: 19.81×10-24 cm3; (17)Surface Tension: 58.7 dyne/cm; (18)Density: 1.364 g/cm3; (19)Flash Point: 237.5 °C; (20)Enthalpy of Vaporization: 77.06 kJ/mol; (21)Boiling Point: 469.2 °C at 760 mmHg; (22)Vapour Pressure: 1.32E-09 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=S(=O)(c1ccc(N)cc1)CCO
(2) InChI: InChI=1/C8H11NO3S/c9-7-1-3-8(4-2-7)13(11,12)6-5-10/h1-4,10H,5-6,9H2
(3) InChIKey: CSCNRHJJGXZFGX-UHFFFAOYAI