IUPAC Name: [2-(4-chloro-N-methylanilino)-2-oxoethyl]-diethylazanium chloride
Molecular Formula: C13H20Cl2N2O
Molecular Weight: 291.216700 g/mol
Canonical SMILES: CC[NH+](CC)CC(=O)N(C)C1=CC=C(C=C1)Cl.[Cl-]
InChI: InChI=1/C13H19ClN2O.ClH/c1-4-16(5-2)10-13(17)15(3)12-8-6-11(14)7-9-12;/h6-9H,4-5,10H2,1-3H3;1H
Classification Code: Drug / Therapeutic Agent ,Skin / Eye Irritant
H-Bond Donor: 1
H-Bond Acceptor: 2
Rotatable Bond Count: 5
Exact Mass: 290.095269
MonoIsotopic Mass: 290.095269
Topological Polar Surface Area: 24.8
Heavy Atom Count: 18
Complexity: 236
Flash Point: 164.9 °C
Enthalpy of Vaporization: 59.35 kJ/mol
Boiling Point: 349.1 °C at 760 mmHg
Vapour Pressure of Acetanilide, 4'-chloro-2-(diethylamino)-N-methyl-,hydrochloride (CAS NO.74816-32-3): 4.83E-05 mmHg at 25 °C
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Source |
---|---|---|---|---|
mouse | LD50 | subcutaneous | 350mg/kg (350mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 8, Pg. 609, 1958. |
rat | LD50 | intraperitoneal | 220mg/kg (220mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 8, Pg. 609, 1958. |
Poison by intraperitoneal and subcutaneous routes. An eye irritant. When heated to decomposition Acetanilide, 4'-chloro-2-(diethylamino)-N-methyl-,hydrochloride (CAS NO.74816-32-3) emits very toxic fumes of NOx and Cl−.
Acetanilide, 4'-chloro-2-(diethylamino)-N-methyl-,hydrochloride (CAS NO.74816-32-3) can be called 4'-Chloro-2-(diethylamino)-N-methylacetanilide hydrochloride .
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