Physicochemical Properties
| Molecular Formula | C12H21NNAO5S |
| Molecular Weight | 314.3536 |
| Exact Mass | 295.085 |
| CAS # | 82611-88-9 |
| PubChem CID | 23709986 |
| Appearance | White to gray solid powder |
| LogP | 2.537 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Heavy Atom Count | 19 |
| Complexity | 331 |
| Defined Atom Stereocenter Count | 0 |
| SMILES | [Na].O=S(CCCN(CC)C1C=C(OC)C=CC=1)(O)=O |
| 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 Note: Please store this product in a sealed and protected environment (e.g. under nitrogen), avoid exposure to moisture and light. |
| 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) | H2O : ≥ 100 mg/mL (~338.60 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: 100 mg/mL (338.60 mM) in PBS (add these co-solvents sequentially from left to right, and one by one), clear solution; with sonication.  (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 3.1812 mL | 15.9058 mL | 31.8117 mL | |
| 5 mM | 0.6362 mL | 3.1812 mL | 6.3623 mL | |
| 10 mM | 0.3181 mL | 1.5906 mL | 3.1812 mL |