-
Name
S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-pentyl-3-pyridinylcarbonimidothioate
- EINECS
- CAS No. 51308-67-9
- Density 1.091g/cm3
- Solubility
- Melting Point
- Formula C22H30 N2 O S
- Boiling Point
- Molecular Weight 370.559
- Flash Point
- Transport Information
- Appearance
- Safety Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx and SOx.
- Risk Codes
-
Molecular Structure
- Hazard Symbols Moderately toxic by ingestion.
- Synonyms S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-pentyl-3-pyridinylcarbonimidothioate
- PSA 70.78000
- LogP 6.59070
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.
Related Products
- S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-ethyl 3-pyridinylcarbonimidothioate
- S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-octyl 3-pyridinylcarbonimidothioate
- S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-pentyl 3-pyridinylcarbonimidothioate
- S-((4-(1,1-Dimethylethyl)phenyl)methyl) O-propyl 3-pyridinylcarbonimidothioate
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