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| CAS No.: | 968-58-1 |
|---|---|
| Name: | alpha,alpha-diphenylpiperidine-1-propanol hydrochloride |
| Article Data: | 1 |
| Molecular Structure: | |
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| Formula: | C20H25 N O . Cl H |
| Molecular Weight: | 331.886 |
| Synonyms: | 1-Piperidinepropanol,a,a-diphenyl-, hydrochloride (6CI,7CI,8CI,9CI); Parks 12;Pridinol hydrochloride; Ridinol; a,a-Diphenyl-1-piperidinepropanolhydrochloride |
| Density: | 1.079g/cm3 |
| Melting Point: | 120-121oC |
| Boiling Point: | 460.9°Cat760mmHg |
| Flash Point: | 229.9°C |
| Safety: | Poison by intraperitoneal and intravenous routes. When heated to decomposition it emits very toxic fumes of NOx and HCl. |
| PSA: | 23.47000 |
| LogP: | 4.53840 |
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Chemistry
IUPAC Name: 1,1-diphenyl-3-piperidin-1-ylpropan-1-ol hydrochloride
Molecular Formula C20H26ClNO
Molecular Weight 331.87954g/mol
H-Bond Donor: 2
H-Bond Acceptor: 2
Rotatable Bond Count: 5
Exact Mass: 331.170292
MonoIsotopic Mass: 331.170292
Topological Polar Surface Area: 23.5
Heavy Atom Count: 23
Formal Charge: 0
Complexity: 294
Flash Point: 229.9 °C
Enthalpy of Vaporization: 76.04 kJ/mol
Boiling Point: 460.9 °C at 760 mmHg
Vapour Pressure: 2.71E-09 mmHg at 25°C
Canonical SMILES: C1CCN(CC1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)O.Cl
InChI: InChI=1S/C20H25NO.ClH/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21;/h1-2,4-7,10-13,22H,3,8-9,14-17H2;1H
InChIKey: IECCHUISCGCKKS-UHFFFAOYSA-N
Structure of Pridinol hydrochloride (CAS NO.968-58-1):
Toxicity Data With Reference
| 1. | ipr-rat LD50:91 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 96 (1949),151. | ||
| 2. | ivn-rat LD50:33 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 96 (1949),151. | ||
| 3. | ipr-mus LD50:131 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 96 (1949),151. | ||
| 4. | ivn-mus LD50:25 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 116 (1956),177. |
Safety Profile
Poison by intraperitoneal and intravenous routes. When heated to decomposition it emits very toxic fumes of NOx and HCl.
Specification
Pridinol hydrochloride , its cas register number is 968-58-1. It also can be called 1,1-Diphenyl-3-(1-piperidyl)-1-propanol hydrochloride ; 3-(N-Piperidyl)-1,1-diphenyl-1-propanol hydrochloride ; Benzhydrol, alpha-(2-piperidylethyl)-, hydrochloride ; INECS 213-529-9 ; Mitanoline ; Par KS-12 ; Pridinol HCl ; Pridinol hydrochloride ; alpha,alpha-Diphenyl-1-piperidinepropanol hydrochloride ; alpha-(2-Piperidylethyl) benzhydrol hydrochloride . When Pridinol hydrochloride (CAS NO.968-58-1) is heated to decomposition, it emits very toxic fumes of NOx and HCl.