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| CAS No.: | 50335-09-6 |
|---|---|
| Name: | O-{2,4-dichloro-6-[(diethylamino)methyl]phenyl} hydrogen ethylphosphonothioate |
| Molecular Structure: | |
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| Formula: | C13H20Cl2NO2PS |
| Molecular Weight: | 356.2482 |
| Density: | 1.305g/cm3 |
| Boiling Point: | 431.9°Cat760mmHg |
| Flash Point: | 215°C |
| Safety: | Poison by ingestion and skin contact. When heated to decomposition it emits very toxic fumes of POx, SOx, and Cl−. See also ESTERS. |
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Chemistry
IUPAC Name: N-[[3,5-dichloro-2-[ethyl(hydroxy)phosphinothioyl]oxyphenyl]methyl]-N-ethylethanamine
Empirical Formula: C13H20Cl2NO2PS
Molecular Weight: 356.2482g/mol
Index of Refraction: 1.574
Molar Refractivity: 90.19 cm3
Molar Volume: 272.9 cm3
Polarizability: 35.75×10-24cm3
Surface Tension: 50.4 dyne/cm
Density: 1.305 g/cm3
Flash Point: 215 °C
Enthalpy of Vaporization: 72.48 kJ/mol
Boiling Point: 431.9 °C at 760 mmHg
Vapour Pressure: 3.17E-08 mmHg at 25°C
Canonical SMILES: CCN(CC)CC1=CC(=CC(=C1OP(=S)(CC)O)Cl)Cl
InChI: InChI=1S/C13H20Cl2NO2PS/c1-4-16(5-2)9-10-7-11(14)8-12(15)13(10)18-19(17,20)6-3/h7-8H,4-6,9H2,1-3H3,(H,17,20)
InChIKey: BAAZDIIPNVKXTH-UHFFFAOYSA-N
Structure of Ethylphosphonothioic acid (2-diethylaminomethyl)-4,6-dichlorophenyl ester (CAS NO.50335-09-6):
.bmp)
Toxicity Data With Reference
| 1. | orl-bwd LD50:4200 µg/kg | TXAPA9 Toxicology and Applied Pharmacology. 26 (1973),154. | ||
| 2. | skn-bwd LD50:5600 µg/kg | TXAPA9 Toxicology and Applied Pharmacology. 26 (1973),154. |
Safety Profile
Poison by ingestion and skin contact. When heated to decomposition it emits very toxic fumes of POx, SOx, and Cl−. See also ESTERS.
Specification
Ethylphosphonothioic acid (2-diethylaminomethyl)-4,6-dichlorophenyl ester , its cas register number is 50335-09-6. It also can be called BAY 50519 ; Phosphonothioic acid, ethyl-, (2-diethylaminomethyl)-4,6-dichlorophenyl ester . Ethylphosphonothioic acid (2-diethylaminomethyl)-4,6-dichlorophenyl ester (CAS NO.50335-09-6) is toxic ingestion and skin contact. When heated to decomposition it emits very toxic fumes of POx, SOx, and Cl−.