IUPAC Name: 1-Ethoxy-2-[2-(2-sulfosulfanylethylamino)ethoxy]benzene
Synonyms of S-2-((2-(o-Ethoxyphenoxy)ethyl)amino)ethyl thiosulfate (CAS NO.21224-77-1): 2-((2-(o-Ethoxyphenoxy)ethyl)amino)ethanethiol hydrogen sulfate (ester) ; Ethanethiol, 2-(2-(o-ethoxyphenoxy)ethyl)amino-, hydrogen sulfate (ester)
InChI: InChI=1/C12H19NO5S2/c1-2-17-11-5-3-4-6-12(11)18-9-7-13-8-10-19-20(14,15)16/h3-6,13H,2,7-10H2,1H3,(H,14,15,16)
CAS NO: 21224-77-1
Molecular Formula: C12H19NO5S2
Molecular Weight : 321.413
Molecular Structure:
H bond acceptors: 6
H bond donors: 2
Freely Rotating Bonds: 10
Polar Surface Area: 98.75 Å2
Index of Refraction: 1.567
Molar Refractivity: 80.03 cm3
Molar Volume: 244.7 cm3
Surface Tension: 52.2 dyne/cm
Density: 1.313 g/cm3
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 150mg/kg (150mg/kg) | Journal of Medicinal Chemistry. Vol. 11, Pg. 1190, 1968. |
Poison by intraperitoneal route. Moderately toxic by ingestion. When S-2-((2-(o-Ethoxyphenoxy)ethyl)amino)ethyl thiosulfate (CAS NO.21224-77-1) is heated to decomposition, it emits very toxic fumes of SOx and NOx. See also SULFATES.
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