The Molecular Structure of Pyrrolidine, 1-(1-(3-(p-fluorobenzoyl)propyl)-4-m-tolylisonipecotoyl)- (CAS NO.2266-22-0) is
Cas Register Number: 2266-22-0
IUPAC Name: 1-(4-Fluorophenyl)-4-[4-(3-methylphenyl)-4-(pyrrolidine-1-carbonyl)piperidin-1-yl]butan-1-one
Synonyms: 1-((1-(4-(4-Fluorophenyl)-4-oxobutyl)-4-(3-methylphenyl)-4-piperidinyl)carbonyl)pyrrolidine ; Meperidide ; Methylperidide ; Pyrrolidine, 1-((1-(4-(4-fluorophenyl)-4-oxobutyl)-4-(3-methylphenyl)-4-piperidinyl)carbonyl)- ; Pyrrolidine, 1-(1-(3-(p-fluorobenzoyl)propyl)-4-m-tolylisonipecotoyl)-
Molecular Formula: C27H33FN2O2
Molecular Weight: 436.561523g/mol
H bond acceptors: 4
H bond donors: 0
Freely Rotating Bonds: 7
Polar Surface Area: 40.62 Å2
Index of Refraction: 1.57
Molar Refractivity: 123.93 cm3
Molar Volume: 377.6 cm3
Surface Tension: 46.1 dyne/cm
Density: 1.155 g/cm3
Flash Point: 323.6 °C
Enthalpy of Vaporization: 90.78 kJ/mol
Boiling Point: 611.4 °C at 760 mmHg
Vapour Pressure of Pyrrolidine, 1-(1-(3-(p-fluorobenzoyl)propyl)-4-m-tolylisonipecotoyl)- (CAS NO.2266-22-0) : 6.9E-15 mmHg at 25°
1. | scu-rat LD50:275 mg/kg | 27ZQAG Psychotropic Drugs and Related Compounds E. Usdin andD.H. Efron,2nd ed.,Washington, DC.: 1972,191. | ||
2. | ivn-rat LD50:9300 µg/kg | 27ZQAG Psychotropic Drugs and Related Compounds E. Usdin andD.H. Efron,2nd ed.,Washington, DC.: 1972,191. | ||
3. | scu-mus LD50:140 mg/kg | 27ZQAG Psychotropic Drugs and Related Compounds E. Usdin andD.H. Efron,2nd ed.,Washington, DC.: 1972,191. | ||
4. | ivn-mus LD50:14 mg/kg | 27ZQAG Psychotropic Drugs and Related Compounds E. Usdin andD.H. Efron,2nd ed.,Washington, DC.: 1972,191. |
Poison by subcutaneous and intravenous routes. When heated to decomposition it emits very toxic fumes of F− and NOx.
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