Product Name: Propenzolate hydrochloride (CAS NO.1420-03-7)
Molecular Formula: C20H29NO3•ClH
Molecular Weight: 367.96g/mol
Mol File: 1420-03-7.mol
Boiling point: 462.7 °C at 760 mmHg
Flash Point: 233.6 °C
Enthalpy of Vaporization: 76.26 kJ/mol
Vapour Pressure: 2.33E-09 mmHg at 25°C
H-Bond Donor: 2
H-Bond Acceptor: 4
Structure Descriptors of Propenzolate hydrochloride (CAS NO.1420-03-7):
IUPAC Name: (1-methylpiperidin-3-yl) 2-cyclohexyl-2-hydroxy-2-phenylacetatehydrochloride
Canonical SMILES: CN1CCCC(C1)OC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O.Cl
InChI: InChI=1S/C20H29NO3.ClH/c1-21-14-8-13-18(15-21)24-19(22)20(23,16-9-4-2-5-10-16)17-11-6-3-7-12-17;/h2,4-5,9-10,17-18,23H,3,6-8,11-15H2,1H3;1H
InChIKey: LBKCCRHBZAWYOP-UHFFFAOYSA-N
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
dog | LD50 | intravenous | 30mg/kg (30mg/kg) | AUTONOMIC NERVOUS SYSTEM: PARASYMPATHOLYTIC | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 153, Pg. 139, 1965. |
dog | LD50 | oral | 330mg/kg (330mg/kg) | AUTONOMIC NERVOUS SYSTEM: PARASYMPATHOLYTIC | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 153, Pg. 139, 1965. |
mouse | LD50 | intraperitoneal | 225mg/kg (225mg/kg) | AUTONOMIC NERVOUS SYSTEM: PARASYMPATHOLYTIC | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 153, Pg. 139, 1965. |
rat | LD50 | intravenous | 25mg/kg (25mg/kg) | AUTONOMIC NERVOUS SYSTEM: PARASYMPATHOLYTIC | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 153, Pg. 139, 1965. |
rat | LD50 | oral | 700mg/kg (700mg/kg) | AUTONOMIC NERVOUS SYSTEM: PARASYMPATHOLYTIC | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 153, Pg. 139, 1965. |
Poison by ingestion, intravenous, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx and HCl.
Propenzolate hydrochloride ,its CAS NO. is 1420-03-7,the synonyms is (+)-1-Methyl-3-piperidyl (+-)-alpha-phenylcyclohexaneglycolate hydrochloride ; 1-Methyl-3-piperidyl alpha-phenylcyclohexaneglycolate hydrochloride ; 3-Piperidinol, 1-methyl-, alpha-phenylcyclohexaneglycolate (ester), hydrochloride ; Delinal ; NDR 263 ; Propenzolate HCl ; d-1-Methyl-3-piperidyl-dl-alpha-phenylcyclohexaneglycolate hydrochloride ; Benzeneacetic acid, alpha-cyclohexyl-alpha-hydroxy-, (+-)-, (+)-1-methyl-3-piperidinyl ester, hydrochloride ; Benzeneacetic acid, alpha-cyclohexyl-alpha-hydroxy-, 1-methyl-3-piperidinyl ester, hydrochloride ; Cyclohexaneglycolic acid, alpha-phenyl-, 1-methyl-3-piperidyl ester, hydrochloride, (+)- .
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