Physicochemical Properties
| Molecular Formula | C₁₄H₁₄O₂ |
| Molecular Weight | 214.26 |
| Exact Mass | 214.099 |
| CAS # | 52340-78-0 |
| PubChem CID | 853019 |
| Appearance | White to off-white solid powder |
| Density | 1.193g/cm3 |
| Boiling Point | 373ºC at 760 mmHg |
| Melting Point | 146-149ºC(lit.) |
| Flash Point | 179.8ºC |
| Index of Refraction | 95 ° (C=1, CHCl3) |
| LogP | 2.453 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Heavy Atom Count | 16 |
| Complexity | 171 |
| Defined Atom Stereocenter Count | 2 |
| SMILES | C1=CC=C(C=C1)[C@H]([C@@H](C2=CC=CC=C2)O)O |
| InChi Key | IHPDTPWNFBQHEB-ZIAGYGMSSA-N |
| InChi Code | InChI=1S/C14H14O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13-16H/t13-,14-/m1/s1 |
| Chemical Name | (1R,2R)-1,2-diphenylethane-1,2-diol |
| Synonyms | (R,R)(+)Hydrobenzoin; (R,R) (+) Hydrobenzoin |
| 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: (1). This product requires protection from light (avoid light exposure) during transportation and storage.(2). Please store this product in a sealed and protected environment (e.g. under nitrogen), avoid exposure to moisture. |
| 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]. Synthesis of enantiopure cyclopentitols and aminocyclopentitols mediated by oxyselenenylation of cyclopentene with (R,R)-hydrobenzoin. Tetrahedron Letters. 1988. [2]. (+)-(1R,2R)-1,2-Diphenylethane-1,2-diol. |
| Additional Infomation | (R,R)-hydrobenzoin is a hydrobenzoin and an ethanediol derivative. |
Solubility Data
| Solubility (In Vitro) | DMSO : ~100 mg/mL (~466.72 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 4.55 mg/mL (21.24 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 45.5 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 (11.67 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 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 3: ≥ 2.5 mg/mL (11.67 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 | 4.6672 mL | 23.3361 mL | 46.6723 mL | |
| 5 mM | 0.9334 mL | 4.6672 mL | 9.3345 mL | |
| 10 mM | 0.4667 mL | 2.3336 mL | 4.6672 mL |