Physicochemical Properties
| Molecular Formula | C22H23NO2 |
| Molecular Weight | 333.42 |
| Exact Mass | 333.172 |
| CAS # | 1354359-53-7 |
| PubChem CID | 57330099 |
| Appearance | White to off-white solid powder |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 486.2±38.0 °C at 760 mmHg |
| Flash Point | 247.9±26.8 °C |
| Vapour Pressure | 0.0±1.2 mmHg at 25°C |
| Index of Refraction | 1.605 |
| LogP | 5.93 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Heavy Atom Count | 25 |
| Complexity | 422 |
| Defined Atom Stereocenter Count | 0 |
| SMILES | CC(C1=CC=CC=C1OC(NCCC2=CC3=CC=CC=C3C=C2)=O)C |
| InChi Key | PCNJGBMWAZRVEA-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C22H23NO2/c1-16(2)20-9-5-6-10-21(20)25-22(24)23-14-13-17-11-12-18-7-3-4-8-19(18)15-17/h3-12,15-16H,13-14H2,1-2H3,(H,23,24) |
| Chemical Name | (2-propan-2-ylphenyl) N-(2-naphthalen-2-ylethyl)carbamate |
| 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: This product requires protection from light (avoid light exposure) during transportation and storage. |
| 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
| Additional Infomation | Carbamic acid, N-[2-(2-naphthalenyl)ethyl]-, 2-(1-methylethyl)phenyl ester is a member of naphthalenes. |
Solubility Data
| Solubility (In Vitro) | DMSO : ~100 mg/mL (~299.92 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: 2.5 mg/mL (7.50 mM) in 10% DMSO + 90% (20% SBE-β-CD in Saline) (add these co-solvents sequentially from left to right, and one by one), suspension solution; with sonication. 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 20% SBE-β-CD physiological saline solution and mix evenly. Preparation of 20% SBE-β-CD in Saline (4°C,1 week): Dissolve 2 g SBE-β-CD in 10 mL saline to obtain a clear solution. Solubility in Formulation 2: ≥ 2.5 mg/mL (7.50 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 | 2.9992 mL | 14.9961 mL | 29.9922 mL | |
| 5 mM | 0.5998 mL | 2.9992 mL | 5.9984 mL | |
| 10 mM | 0.2999 mL | 1.4996 mL | 2.9992 mL |