Physicochemical Properties
| Molecular Formula | C9H19NO3S |
| Molecular Weight | 221.32 |
| Exact Mass | 259.085 |
| CAS # | 1135-40-6 |
| Related CAS # | 3-(Cyclohexylamino)-1-propanesulfonic Acid-d17;1219804-15-5 |
| PubChem CID | 70815 |
| Appearance | White to off-white solid powder |
| Density | 1.2±0.1 g/cm3 |
| Melting Point | >300 °C(lit.) |
| Index of Refraction | 1.515 |
| LogP | 0.05 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Heavy Atom Count | 14 |
| Complexity | 239 |
| Defined Atom Stereocenter Count | 0 |
| SMILES | S(C([H])([H])C([H])([H])C([H])([H])N([H])C1([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H])(=O)(=O)O[H] |
| InChi Key | PJWWRFATQTVXHA-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C9H19NO3S/c11-14(12,13)8-4-7-10-9-5-2-1-3-6-9/h9-10H,1-8H2,(H,11,12,13) |
| Chemical Name | 3-(cyclohexylamino)propane-1-sulfonic 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 |
| 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
| ln Vitro | Because amines do not ionize at high pH values, CAPS surfactants have a single negative charge [1]. |
| References |
[1]. Ion Interaction: The Energetics and Mechanism of The Competitive Behavior Between Two Similarly Charged Molecules. 1. The Effect of Ionic Strength, Acetonitrile and Surfactant Concentration. Journal of Liquid Chromatography, 1985, 8(13):2417-2443. [2]. The effect of the dimeric and multimeric forms of fibronectin on the adhesion and growth of primary glomerular cells. Exp Cell Res. 1983 May;145(2):265-76. |
| Additional Infomation | Cyclohexylaminopropanesulfonic acid is an amine. |
Solubility Data
| Solubility (In Vitro) |
H2O : ~125 mg/mL (~564.79 mM) DMSO : ~5 mg/mL (~22.59 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 0.5 mg/mL (2.26 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 5.0 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: ≥ 0.5 mg/mL (2.26 mM) (saturation unknown) in 10% DMSO + 90% (20% SBE-β-CD in 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 5.0 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.  (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 4.5183 mL | 22.5917 mL | 45.1834 mL | |
| 5 mM | 0.9037 mL | 4.5183 mL | 9.0367 mL | |
| 10 mM | 0.4518 mL | 2.2592 mL | 4.5183 mL |