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| Name |
S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-pentyl 3-pyridinylcarbonimidothioate |
EINECS | N/A |
| CAS No. | 51308-67-9 | Density | 1.091g/cm3 |
| PSA | 70.78000 | LogP | 6.59070 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C22H30 N2 O S | Boiling Point | N/A |
| Molecular Weight | 370.559 | Flash Point | N/A |
| 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-pentyl-3-pyridinylcarbonimidothioate |
S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-pentyl 3-pyridinylcarbonimidothioate Chemical Properties
IUPAC Name: S-[(4-tert-butylphenyl)methyl] N-(2-pentylpyridin-3-yl)carbamothioate
Synonyms of S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-pentyl 3-pyridinylcarbonimidothioate (CAS NO.51308-67-9): Carbonimidothioic acid, 3-pyridinyl-, S-((4-(1,1-dimethylethyl)phenyl)methyl) O-pentyl ester
InChI: InChI=1/C22H30N2OS/c1-5-6-7-9-19-20(10-8-15-23-19)24-21(25)26-16-17-11-13-18(14-12-17)22(2,3)4/h8,10-15H,5-7,9,16H2,1-4H3,(H,24,25)
CAS NO: 51308-67-9
Molecular Formula: C22H30N2OS
Molecular Weight : 370.5514
Molecular Structure: .png)
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 9
Polar Surface Area: 58.5 Å2
Index of Refraction: 1.579
Molar Refractivity: 112.93 cm3
Molar Volume: 339.4 cm3
Surface Tension: 43.5 dyne/cm
Density: 1.091 g/cm3
S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-pentyl 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-pentyl 3-pyridinylcarbonimidothioate Safety Profile
Moderately toxic by ingestion. When S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-pentyl 3-pyridinylcarbonimidothioate (CAS NO.51308-67-9) is heated to decomposition, it emits toxic vapors of NOx and SOx.
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