Physicochemical Properties
| Molecular Formula | C7H11NO2 |
| Molecular Weight | 141.1677 |
| Exact Mass | 141.078 |
| CAS # | 499-04-7 |
| Related CAS # | Arecaidine hydrochloride;6018-28-6;Arecaidine hydrobromide;6013-57-6 |
| PubChem CID | 10355 |
| Appearance | White to off-white solid powder |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 266.7±35.0 °C at 760 mmHg |
| Melting Point | 232ºC (dec.) |
| Flash Point | 115.1±25.9 °C |
| Vapour Pressure | 0.0±1.1 mmHg at 25°C |
| Index of Refraction | 1.524 |
| LogP | 0.77 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Heavy Atom Count | 10 |
| Complexity | 174 |
| Defined Atom Stereocenter Count | 0 |
| InChi Key | DNJFTXKSFAMXQF-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C7H11NO2/c1-8-4-2-3-6(5-8)7(9)10/h3H,2,4-5H2,1H3,(H,9,10) |
| Chemical Name | 1-methyl-3,6-dihydro-2H-pyridine-5-carboxylic acid |
| 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
| References |
[1]. Effects of the Areca nut constituents arecaidine and guvacine on the action of GABA in the cat central nervous system. Brain Res. 1977 Nov 18;136(3):513-22. [2]. Transport of the areca nut alkaloid arecaidine by the human proton-coupled amino acid transporter 1 (hPAT1). J Pharm Pharmacol. 2013 Apr;65(4):582-90. |
| Additional Infomation |
Arecaidine is a citraconoyl group. Arecaidine has been reported in Areca catechu with data available. See also: Arecaidine hydrochloride (annotation moved to). |
Solubility Data
| Solubility (In Vitro) | H2O : ~250 mg/mL (~1770.91 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: 100 mg/mL (708.37 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 | 7.0837 mL | 35.4183 mL | 70.8366 mL | |
| 5 mM | 1.4167 mL | 7.0837 mL | 14.1673 mL | |
| 10 mM | 0.7084 mL | 3.5418 mL | 7.0837 mL |