Physicochemical Properties
| Molecular Formula | C5H2CL3N |
| Molecular Weight | 182.44 |
| Exact Mass | 180.925 |
| CAS # | 16063-70-0 |
| PubChem CID | 27666 |
| Appearance | White to light brown solid powder |
| Density | 1.5±0.1 g/cm3 |
| Boiling Point | 215.7±35.0 °C at 760 mmHg |
| Melting Point | 46-50 °C(lit.) |
| Flash Point | 104.7±11.5 °C |
| Vapour Pressure | 0.2±0.4 mmHg at 25°C |
| Index of Refraction | 1.573 |
| LogP | 2.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Heavy Atom Count | 9 |
| Complexity | 98.2 |
| Defined Atom Stereocenter Count | 0 |
| SMILES | C1=C(C=NC(=C1Cl)Cl)Cl |
| InChi Key | CNLIIAKAAMFCJG-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C5H2Cl3N/c6-3-1-4(7)5(8)9-2-3/h1-2H |
| Chemical Name | 2,3,5-trichloropyridine |
| HS Tariff Code | 2934.99.9001 |
| Storage |
Powder-20°C 3 years 4°C 2 years In solvent -80°C 6 months -20°C 1 month |
| Shipping Condition | Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs) |
Biological Activity
Solubility Data
| Solubility (In Vitro) | DMSO: 100 mg/mL (548.13 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (13.70 mM) (saturation unknown) in 10% DMSO + 40% PEG300 + 5% Tween80 + 45% Saline (add these co-solvents sequentially from left to right, and one by one), clear solution. For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 400 μL PEG300 and mix evenly; then add 50 μL Tween-80 to the above solution and mix evenly; then add 450 μL normal saline to adjust the volume to 1 mL. Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH₂ O to obtain a clear solution. Solubility in Formulation 2: ≥ 2.5 mg/mL (13.70 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), clear solution. For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 900 μL of corn oil and mix evenly.  (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 5.4813 mL | 27.4063 mL | 54.8125 mL | |
| 5 mM | 1.0963 mL | 5.4813 mL | 10.9625 mL | |
| 10 mM | 0.5481 mL | 2.7406 mL | 5.4813 mL |