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| Name |
S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-propyl 3-pyridinylcarbonimidothioate |
EINECS | N/A |
| CAS No. | 51308-62-4 | Density | 1.117g/cm3 |
| PSA | 70.78000 | LogP | 5.81050 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C20H26 N2 O S | Boiling Point | °Cat760mmHg |
| Molecular Weight | 342.505 | Flash Point | °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx and SOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | Moderately toxic by ingestion. |
| Synonyms |
S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-propyl 3-pyridinylcarbonimidothioate |
S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-propyl 3-pyridinylcarbonimidothioate Chemical Properties
IUPAC Name: S-[(4-tert-Butylphenyl)methyl] N-(2-propylpyridin-3-yl)carbamothioate
Synonyms of S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-propyl 3-pyridinylcarbonimidothioate (CAS NO.51308-62-4): Carbonimidothioic acid, 3-pyridinyl-, S-((4-(1,1-dimethylethyl)phenyl)methyl) O-propyl ester
InChI: InChI=1/C20H26N2OS/c1-5-7-17-18(8-6-13-21-17)22-19(23)24-14-15-9-11-16(12-10-15)20(2,3)4/h6,8-13H,5,7,14H2,1-4H3,(H,22,23)
CAS NO: 51308-62-4
Molecular Formula: C20H26N2OS
Molecular Weight : 342.4982
Molecular Structure: .png)
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 7
Polar Surface Area: 58.5 Å2
Index of Refraction: 1.591
Molar Refractivity: 103.66 cm3
Molar Volume: 306.4 cm3
S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-propyl 3-pyridinylcarbonimidothioate Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | oral | > 1gm/kg (1000mg/kg) | United States Patent Document. Vol. 3899582 |
S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-propyl 3-pyridinylcarbonimidothioate Safety Profile
Moderately toxic by ingestion. When S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-propyl 3-pyridinylcarbonimidothioate (CAS NO.51308-62-4) is heated to decomposition, it emits toxic vapors of NOx and SOx.
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