- S-(4-tert-butylbenzyl) (2-cyclohexylpyridin-3-yl)thiocarbamate
- S-(4-tert-butylbenzyl) (2-cyclopentylpyridin-3-yl)thiocarbamate
- S-(4-tert-butylbenzyl) [2-(1,2-dimethylpropyl)pyridin-3-yl]thiocarbamate
- S-(4-tert-butylbenzyl) [2-(1-methylpropyl)pyridin-3-yl]thiocarbamate
- S-(4-tert-butylbenzyl) [2-(2,5-dimethylcyclohexyl)pyridin-3-yl]thiocarbamate
- S-(4-tert-butylbenzyl) [2-(2-methylcyclohexyl)pyridin-3-yl]thiocarbamate
- S-(4-tert-butylbenzyl) [2-(2-methylpropyl)pyridin-3-yl]thiocarbamate
- S-(4-tert-butylbenzyl) [2-(3,5-dimethylcyclohexyl)pyridin-3-yl]thiocarbamate
- S-(4-tert-butylbenzyl) [2-(3-methylbutyl)pyridin-3-yl]thiocarbamate
- 51308-99-71-Nonanol, 9-chloro-
- 51-30-9Isoprenaline hydrochloride
- 51309-30-91,4-Butanediol, polymer with alpha-hydro-omega-hydroxypoly(oxy-1,4-butanediyl), alpha-hydro-omega-hydroxypoly(oxy(methyl-1,2-ethanediyl)) and 1,1-methylenebis(4-isocyanatobenzene)
- 513-10-0Ethanaminium,2-[(diethoxyphosphinyl)thio]-N,N,N-trimethyl-, iodide (1:1)
- 51310-54-41H-Indole,2-(trifluoromethyl)-
- 51311-17-2Carbon fluoride
- 513-12-2Ethanol,2-(ethylsulfonyl)-
- 51312-42-6SODIUM PHOSPHOTUNGSTATE
- 51315-07-22-Pyridinecarbonitrile,3-nitro-
- 5131-58-84-Nitro-m-phenylenediamine
Hot Products
- 104987-11-3Tacrolimus
- 141-53-7Sodium formate
- 8001-54-5Quaternary ammonium compounds, alkylbenzyldimethyl, chlorides
- 9003-39-8Povidone
- 10161-34-9Trenbolone acetate
- 402957-28-2Telaprevir
- 68-19-9Cyanocobalamin
- 7631-86-9Silicon dioxide
- 302-79-4Tretinoin
- 77-92-9Citric acid
|
Basic Information |
|
Post buying leads |
|
Suppliers |
| Name |
S-(4-tert-butylbenzyl) [2-(1,2-dimethylpropyl)pyridin-3-yl]thiocarbamate |
EINECS | N/A |
| CAS No. | 51308-69-1 | Density | 1.088g/cm3 |
| PSA | 70.78000 | LogP | 6.61750 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C22H30 N2 O S | Boiling Point | °Cat760mmHg |
| Molecular Weight | 370.559 | 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-(1,2-dimethylpropyl)- 3-pyridinylcarbonimidothioate |
S-(4-tert-butylbenzyl) [2-(1,2-dimethylpropyl)pyridin-3-yl]thiocarbamate Chemical Properties
IUPAC Name: S-[(4-tert-Butylphenyl)methyl] N-[2-(3-methylbutan-2-yl)pyridin-3-yl]carbamothioate
Synonyms of S-[(4-tert-Butylphenyl)methyl] N-[2-(3-methylbutan-2-yl)pyridin-3-yl]carbamothioate (CAS NO.51308-69-1): Carbonimidothioic acid, 3-pyridinyl-, S-((4-(1,1-dimethylethyl)phenyl)methyl)O-(1,2-dimethylpropyl) ester
CAS NO: 51308-69-1
Molecular Formula: C22H30N2OS
Molecular Weight: 370.5514
Molecular Structure: .png)
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 7
Polar Surface Area: 58.5 Å2
Index of Refraction: 1.577
Molar Refractivity: 112.89 cm3
Molar Volume: 340.5 cm3
Surface Tension: 42.1 dyne/cm
Density: 1.088 g/cm3
SMILES: O=C(SCc1ccc(cc1)C(C)(C)C)Nc2cccnc2C(C(C)C)C
InChI: InChI=1/C22H30N2OS/c1-15(2)16(3)20-19(8-7-13-23-20)24-21(25)26-14-17-9-11-18(12-10-17)22(4,5)6/h7-13,15-16H,14H2,1-6H3,(H,24,25) Copy
InChIKey: NKUJBMWSEPQKLQ-UHFFFAOYAM
Std. InChI: InChI=1S/C22H30N2OS/c1-15(2)16(3)20-19(8-7-13-23-20)24-21(25)26-14-17-9-11-18(12-10-17)22(4,5)6/h7-13,15-16H,14H2,1-6H3,(H,24,25)
Std. InChIKey: NKUJBMWSEPQKLQ-UHFFFAOYSA-N
S-(4-tert-butylbenzyl) [2-(1,2-dimethylpropyl)pyridin-3-yl]thiocarbamate 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-tert-butylbenzyl) [2-(1,2-dimethylpropyl)pyridin-3-yl]thiocarbamate Safety Profile
Moderately toxic by ingestion. When S-[(4-tert-Butylphenyl)methyl] N-[2-(3-methylbutan-2-yl)pyridin-3-yl]carbamothioate (CAS NO.51308-69-1) is heated to decomposition, it emits toxic vapors of NOx and SOx.
What can I do for you?
Get Best Price
