IUPAC Name: N-(2-Butylpyridin-3-yl)-1-(3,4-dichlorophenyl)sulfanyl-1-methylsulfanylmethanimine
Synonyms of Butyl (3,4-dichlorophenyl)methyl 3-pyridinylcarbonimidodithioate (CAS NO.34763-43-4): Carbonimidodithioic acid, 3-pyridinyl-, butyl (3,4-dichlorophenyl)methyl ester
InChI: InChI=1/C17H18Cl2N2S2/c1-3-4-6-15-16(7-5-10-20-15)21-17(22-2)23-12-8-9-13(18)14(19)11-12/h5,7-11H,3-4,6H2,1-2H3/b21-17+
InChIKey: LRXGSIOYNNHCPZ-HEHNFIMWBU
Std. InChI: InChI=1S/C17H18Cl2N2S2/c1-3-4-6-15-16(7-5-10-20-15)21-17(22-2)23-12-8-9-13(18)14(19)11-12/h5,7-11H,3-4,6H2,1-2H3/b21-17+
Std. InChIKey: LRXGSIOYNNHCPZ-HEHNFIMWSA-N
CAS NO: 34763-43-4
Molecular Formula: C17H18Cl2N2S2
Molecular Weight: 385.3742
Molecular Structure :
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 7
Polar Surface Area: 75.85 Å2
Index of Refraction: 1.615
Molar Refractivity: 106.35 cm3
Molar Volume: 304.5 cm3
Surface Tension: 43.5 dyne/cm
Density: 1.26 g/cm3
Flash Point: 267.5 °C
Enthalpy of Vaporization: 76.15 kJ/mol
Boiling Point: 518.7 °C at 760 mmHg
Vapour Pressure: 2.39E-10 mmHg at 25°C
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | oral | 800mg/kg (800mg/kg) | United States Patent Document. Vol. 3899582 |
Moderately toxic by ingestion. When Butyl (3,4-dichlorophenyl)methyl 3-pyridinylcarbonimidodithioate (CAS NO.34763-43-4) is heated to decomposition, it emits toxic vapors of NOx, SOx, and Cl−.
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