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51379-05-6

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Basic Information
CAS No.: 51379-05-6
Name: (4-(1,1-Dimethylethyl)phenyl)methyl 1,1-dimethylpropyl-3-pyridinylcarbonimidodithioate
Molecular Structure:
Molecular Structure of 51379-05-6 ((4-(1,1-Dimethylethyl)phenyl)methyl 1,1-dimethylpropyl-3-pyridinylcarbonimidodithioate)
Formula: C22H30 N2 S2
Molecular Weight: 386.626
Synonyms: (4-(1,1-Dimethylethyl)phenyl)methyl 1,1-dimethylpropyl-3-pyridinylcarbonimidodithioate
Density: 1.03g/cm3
Boiling Point: 504.8°C at 760 mmHg
Flash Point: 259.1°C
Hazard Symbols: Moderately toxic by ingestion.
Safety: Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx and SOx.
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  • (4-(1,1-DIMETHYLETHYL)PHENYL)METHYL 1,1-DIMETHYLPROPYL-PYRIDIN-3-YLCARBONIMIDODITHIOATE

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    51379-05-6

    (4-(1,1-DIMETHYLETHYL)PHENYL)METHYL 1,1-DIMETHYLPROPYL-PYRIDIN-3-YLCARBONIMIDODITHIOATE

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    (4-(1,1-DIMETHYLETHYL)PHENYL)METHYL 1,1-DIMETHYLPROPYL-PYRIDIN-3-YLCARBONIMIDODITHIOATEAppearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by ex

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Chemistry

IUPAC Name: 1-[(4-tert-Butylphenyl)methylsulfanyl]-1-(2-methylbutan-2-ylsulfanyl)-N-pyridin-3-ylmethanimine 
Following is the structure of 3-Pyridinylcarbonimidodithioic acid, (4-(1,1-dimethylethyl)phenyl)methyl 1,1-dimethylpropyl ester (CAS NO.51379-05-6):
                         
Empirical Formula: C22H30N2S2
Molecular Weight: 386.617 g/mol
Surface Tension: 36.3 dyne/cm
Density: 1.03 g/cm3
Flash Point: 259.1 °C
Enthalpy of Vaporization: 74.5 kJ/mol
Boiling Point: 504.8 °C at 760 mmHg
Vapour Pressure: 8.11E-10 mmHg at 25 °C
Index of Refraction of 3-Pyridinylcarbonimidodithioic acid, (4-(1,1-dimethylethyl)phenyl)methyl 1,1-dimethylpropyl ester (CAS NO.51379-05-6): 1.558
Canonical SMILES: CCC(C)(C)SC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)(C)C
InChI: InChI=1S/C22H30N2S2/c1-7-22(5,6)26-20(24-19-9-8-14-23-15-19)25-16-17-10-12-18(13-11-17)21(2,3)4/h8-15H,7,16H2,1-6H3
InChIKey: JYNYZPXEADUWKZ-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

orl-mus LD50:>1 g/kg

     USXXAM    United States Patent Document. (Commissioner of Patents and Trademarks, Washington, DC 20231) #3899582 .

Safety Profile

 Moderately is toxic by ingestion. When heated to decomposition, 3-Pyridinylcarbonimidodithioic acid, (4-(1,1-dimethylethyl)phenyl)methyl 1,1-dimethylpropyl ester (CAS NO.51379-05-6) emits toxic vapors of NOx and SOx.

Specification

 3-Pyridinylcarbonimidodithioic acid, (4-(1,1-dimethylethyl)phenyl)methyl 1,1-dimethylpropyl ester , its cas register number is 51379-05-6. It also can be called Carbonimidodithioic acid, 3-pyridinyl-, (4-(1,1-dimethylethyl)phenyl)methyl 1,1-dimethylpropyl ester . Its classification code Agricultural Chemical and Fungicide, bactericide, wood preservative.