Product Name: 4-Hexyloxy-beta-(1-piperidyl)propiophenone hydrochloride (CAS NO.5289-93-0)
Molecular Formula: C20H31NO2•ClH
Molecular Weight: 353.98g/mol
Mol File: 5289-93-0.mol
Boiling point: 450.2 °C at 760 mmHg
Flash Point: 226.1 °C
Enthalpy of Vaporization: 70.9 kJ/mol
Vapour Pressure: 2.7E-08 mmHg at 25°C
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of 4-Hexyloxy-beta-(1-piperidyl)propiophenone hydrochloride (CAS NO.5289-93-0):
IUPAC Name: 1-(4-Hexoxyphenyl)-3-piperidin-1-ylpropan-1-one hydrochloride
Canonical SMILES: CCCCCCOC1=CC=C(C=C1)C(=O)CCN2CCCCC2.Cl
InChI: InChI=1S/C20H31NO2.ClH/c1-2-3-4-8-17-23-19-11-9-18(10-12-19)20(22)13-16-21-14-6-5-7-15-21;/h9-12H,2-8,13-17H2,1H3;1H
InChIKey: DCHWVEQDWXZLIN-UHFFFAOYSA-N
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 52mg/kg (52mg/kg) | BEHAVIORAL: ATAXIA BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY) BEHAVIORAL: IRRITABILITY | Journal of Pharmacology and Experimental Therapeutics. Vol. 115, Pg. 419, 1955. |
mouse | LD50 | intravenous | 15mg/kg (15mg/kg) | Comptes Rendus Hebdomadaires des Seances, Academie des Sciences. Vol. 241, Pg. 1523, 1955. |
Poison by intraperitoneal and intravenous routes. When heated to decomposition it emits very toxic fumes of NOx and HCl.
4-Hexyloxy-beta-(1-piperidyl)propiophenone hydrochloride , its CAS NO. is 5289-93-0, the synonyms are 4'-(Hexyloxy)-3-piperidinopropiophenone hydrochloride ; Propiophenone, 4'-hexyloxy-3-piperidino-, hydrochloride .
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