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CAS No.: | 138908-40-4 |
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Name: | CL 316243 |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C20H18ClNO7•2Na |
Molecular Weight: | 465.80 |
Synonyms: | Disodium (R,R)-5-(2-((2-(3-chlorophenyl)-2-hydroxyethyl)-amino)propyl)-1,3-benzodioxole-2,3-dicarboxylate;disodium 5-[(2R)-2-{[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino}propyl]-1,3-benzodioxole-2,2-dicarboxylate;BTA-243;disodium 5-[(2R)-2-[[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]-1,3-benzodioxazole-2,2-dicarboxylate;CL 316,243; |
Density: | g/cm3 |
Boiling Point: | 689.5°Cat760mmHg |
Flash Point: | 370.8°C |
Hazard Symbols: | A poison. |
Safety: | A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx and Cl−. |
PSA: | 130.98000 |
LogP: | -0.04760 |
IUPAC Name: 5-[(2R)-2-[[(2R)-2-(3-Chlorophenyl)-2-hydroxyethyl]amino]propyl]-1,3-benzodioxole-2,2-dicarboxylic acid; sodium
Synonyms of Sodium (R,R)-5-(2-((2-(3-chlorophenyl)-2-hydroxyethyl)amino)propyl)-1,3-benzodioxole-2,2- (CAS NO.138908-40-4): CL 316,243 ; Disodium (R,R)-5-(2-((2-(3-chlorophenyl)-2-hydroxyethyl)-amino)propyl)-1,3-benzodioxole-2,3-dicarboxylate ; 1,3-Benzodioxole-2,2-dicanboxylic acid, 5-(2-((2-(3-chlorophenyl)-2-hydroxyethyl)amino)propyl)-, disodium salt, (R-(R*,R*))-
CAS NO: 138908-40-4
Molecular Formula: C20H20ClNNa2O7
Molecular Weight : 467.8078
Molecular Structure:
H bond acceptors: 8
H bond donors: 4
Freely Rotating Bonds: 9
Polar Surface Area: 83.53 Å2
Flash Point: 370.8 °C
Enthalpy of Vaporization: 106.13 kJ/mol
Boiling Point: 689.5 °C at 760 mmHg
Vapour Pressure: 5.86E-20 mmHg at 25°C
1. | ivn-rat TDLo:1 µg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 293 (2000),939. | ||
2. | ivn-rat TDLo:10 µg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 293 (2000),939. |
A poison by intravenous route. When Sodium (R,R)-5-(2-((2-(3-chlorophenyl)-2-hydroxyethyl)amino)propyl)-1,3-benzodioxole-2,2- (CAS NO.138908-40-4) is heated to decomposition, it emits toxic vapors of NOx and Cl−.