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| CAS No.: | 749-02-0 |
|---|---|
| Name: | SPIPERONE |
| Molecular Structure: | |
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| Formula: | C23H26 F N3 O2 |
| Molecular Weight: | 395.477 |
| Synonyms: | 1,3,8-Triazaspiro[4.5]decan-4-one,8-[3-(p-fluorobenzoyl)propyl]-1-phenyl- (7CI,8CI);8-[3-(4-Fluorobenzoyl)propyl]-4-oxo-1-phenyl-1,3,8-triazaspiro[4,5]decane;8-[3-(p-Fluorobenzoyl)propyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one; NSC170983; R 5147; Spiperone; Spiroperidol; Spiroperidone; Spiropitan |
| Density: | 1.1714 (estimate) |
| Melting Point: | 190-193.60C |
| Boiling Point: | 630.6°C at 760 mmHg |
| Flash Point: | 335.2°C |
| Solubility: | 32mg/L(22 oC) |
| Hazard Symbols: | Xn |
| Risk Codes: | 22-63 |
| Safety: | Poison by intravenous and intramuscular routes. Moderately toxic by ingestion. An experimental teratogen. When heated to decomposition it emits very toxic fumes of F− and NOx. See also FLUORIDES. |
| PSA: | 52.65000 |
| LogP: | 3.54880 |
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Chemistry
IUPAC Name: 8-[4-(4-Fluorophenyl)-4-oxobutyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Molecular Formula: C23H26FN3O2
Molecular Weight: 395.52
Freely Rotating Bonds: 6
Polar Surface Area: 43.86 Å2
Index of Refraction: 1.625
Molar Refractivity: 110.08 cm3
Molar Volume: 311.1 cm3
Polarizability: 43.64 ×10-24 cm3
Surface Tension: 56.7 dyne/cm
Density: 1.27 g/cm3
Flash Point: 335.2 °C
Enthalpy of Vaporization: 93.27 kJ/mol
Boiling Point: 630.6 °C at 760 mmHg
Vapour Pressure: 8.2E-16 mmHg at 25°C
The Cas Register Number of Spiroperidol Spiroperidol is 749-02-0.The chemical synonyms of Spiroperidol (CAS NO.749-02-0) are 1,3,8-Triazaspiro[4.5]decan-4-one, 8-[4-(4-fluorophenyl)-4-oxobutyl]-1-phenyl- ; 4-Phenyl-8-[3-(4-fluorobenzoyl)propyl]-1-oxo-2,4,8-triazaspiro[4.5]decane ; 8-[4-(4-Fluorophenyl)-4-oxobutyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one ; Spiperone and Spiperone .The molecular structure of Spiroperidol (CAS NO.749-02-0) is
.
Uses
Spiroperidol (CAS NO.749-02-0) is used as organic intermediate.
Toxicity Data With Reference
| 1. | ivn-rat LD50:14 mg/kg | 27ZQAG Psychotropic Drugs and Related Compounds E. Usdin andD.H. Efron,2nd ed.,Washington, DC.: 1972,193. | ||
| 2. | ims-rat LD50:168 mg/kg | NIIRDN “Drugs in Japan. Ethical Drugs, 6th Edition 1982” Edited by Japan Pharmaceutical Information Center. 6 (1982),380. | ||
| 3. | orl-mus LD50:600 mg/kg | CHTPBA Chimica Therapeutica. 7 (1972),493. | ||
| 4. | ivn-mus LD50:25,500 µg/kg | NIIRDN “Drugs in Japan. Ethical Drugs, 6th Edition 1982” Edited by Japan Pharmaceutical Information Center. 6 (1982),380. | ||
| 5. | ims-mus LD50:125 mg/kg | NIIRDN “Drugs in Japan. Ethical Drugs, 6th Edition 1982” Edited by Japan Pharmaceutical Information Center. 6 (1982),380. |
Safety Profile
Poison by intravenous and intramuscular routes. Moderately toxic by ingestion. An experimental teratogen. When heated to decomposition it emits very toxic fumes of F− and NOx. See also FLUORIDES.
Hazard Codes: 
Xn
Risk Statements: 22-63
R22: Harmful if swallowed.
R63: Possible risk of harm to the unborn child.
Safety Statements: 36/37
S36/37: Wear suitable protective clothing and gloves.
WGK Germany: 3
RTECS: XX8925000