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| Name |
N-(2-(Diethylamino)ethyl)-1-adamantaneacetamide ethyl iodide |
EINECS | N/A |
| CAS No. | 54099-14-8 | Density | N/A |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C18H32N2O•C2H5I | Boiling Point | 442.2°C at 760 mmHg |
| Molecular Weight | 448.49 | Flash Point | 221.2°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by intraperitoneal route. Moderately toxic by ingestion. See also IODIDES. When heated to decomposition it emits very toxic fumes of NOx and I−. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
N/A |
N-(2-(Diethylamino)ethyl)-1-adamantaneacetamide ethyl iodide Chemical Properties
IUPAC Name: 2-(1-Adamantyl)-N-(2-diethylaminoethyl)acetamide; iodoethane
Synonyms of N-(2-(Diethylamino)ethyl)-1-adamantaneacetamide ethyl iodide (CAS NO.54099-14-8): Ethanaminium, N,N,N-triethyl-2-((tricyclo(3.3.1.1(sup 3,7))dec-1-ylacetyl)amino)-, iodide ; 1-Adamantaneacetamide, N-(2-(diethylamino)ethyl)-, ethyl iodide
InChI: InChI=1/C18H32N2O.C2H5I/c1-3-20(4-2)6-5-19-17(21)13-18-10-14-7-15(11-18)9-16(8-14)12-18;1-2-3/h14-16H,3-13H2,1-2H3,(H,19,21);2H2,1H3
InChIKey: LXGRGWRJGHQXFJ-UHFFFAOYAA
Std. InChI: InChI=1S/C18H32N2O.C2H5I/c1-3-20(4-2)6-5-19-17(21)13-18-10-14-7-15(11-18)9-16(8-14)12-18;1-2-3/h14-16H,3-13H2,1-2H3,(H,19,21);2H2,1H3
Std. InChIKey: LXGRGWRJGHQXFJ-UHFFFAOYSA-N
CAS NO: 54099-14-8
Molecular Formula: C20H37IN2O
Molecular Weight: 448.4251
Molecular Structure : .png)
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 7
Polar Surface Area: 23.55 Å2
Flash Point: 221.2 °C
Enthalpy of Vaporization: 69.97 kJ/mol
Boiling Point: 442.2 °C at 760 mmHg
Vapour Pressure: 5.11E-08 mmHg at 25°C
N-(2-(Diethylamino)ethyl)-1-adamantaneacetamide ethyl iodide Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 35mg/kg (35mg/kg) | Farmaco, Edizione Scientifica. Vol. 32, Pg. 129, 1977. | |
| mouse | LD50 | oral | > 400mg/kg (400mg/kg) | Farmaco, Edizione Scientifica. Vol. 29, Pg. 820, 1974. |
N-(2-(Diethylamino)ethyl)-1-adamantaneacetamide ethyl iodide Safety Profile
Poison by intraperitoneal route. Moderately toxic by ingestion. See also IODIDES. When N-(2-(Diethylamino)ethyl)-1-adamantaneacetamide ethyl iodide (CAS NO.54099-14-8) is heated to decomposition ,it emits very toxic fumes of NOx and I−.
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