Physicochemical Properties
| Molecular Formula | C14H12 |
| Molecular Weight | 180.25 |
| Exact Mass | 180.093 |
| CAS # | 103-30-0 |
| Related CAS # | trans-Stilbene-13C2;153610-50-5;trans-Stilbene-d12;16341-52-9;trans-Stilbene-d10;20748-24-7;trans-Stilbene-d2;5284-44-6 |
| PubChem CID | 638088 |
| Appearance | White to off-white solid powder |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 307.0±0.0 °C at 760 mmHg |
| Melting Point | 123-125 °C(lit.) |
| Flash Point | 128.5±9.7 °C |
| Vapour Pressure | 0.0±0.3 mmHg at 25°C |
| Index of Refraction | 1.659 |
| LogP | 4.83 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 2 |
| Heavy Atom Count | 14 |
| Complexity | 149 |
| Defined Atom Stereocenter Count | 0 |
| SMILES | C1=CC=C(C=C1)/C=C/C2=CC=CC=C2 |
| InChi Key | PJANXHGTPQOBST-VAWYXSNFSA-N |
| InChi Code | InChI=1S/C14H12/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-12H/b12-11+ |
| Chemical Name | (E)-stilbene |
| 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, 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
| ADME/Pharmacokinetics |
Metabolism / Metabolites TRANS-STILBENE GIVES 4-HYDROXY-TRANS-STILBENE IN RABBIT & GUINEA PIG. /FROM TABLE/ STUDY OF RING-HYDROXYLATED METABOLITES OF TRANS-STILBENE /SHOWS/...URINE CONTAINS RANGE OF POLYHYDROXYLATED BIBENZYL DERIVATIVES. ...EVIDENCE /SUGGESTS/ THAT BIBENZYL COMPD ARE FORMED BY MICROFLORAL REDUCTION OF STILBENES. IN GUINEA PIGS & RABBITS, /TRANS-STILBENE/ BIOTRANSFORMATION INTO 4-HYDROXY-, 4,4'-DIHYDROXY-, 3-HYDROXY-4-METHOXY-, & 3-METHOXY-4-HYDROXYSTILBENES OCCURS... HOWEVER, IN MOUSE ONLY LIMITED CONVERSION TO 4,4'-DIHYDROXY- TAKES PLACE. SCHEME FOR OXIDATIVE CLEAVAGE OF ETHYLENIC LINKAGE OF STILBENE IS PRESENTED. For more Metabolism/Metabolites (Complete) data for TRANS-1,2-DIPHENYLETHYLENE (6 total), please visit the HSDB record page. |
| Toxicity/Toxicokinetics |
Non-Human Toxicity Values LD50 Mouse oral 920 mg/kg LD50 Mouse ip 6050 mg/kg |
| References |
[1]. Trans-Stilbenes in Commercial Grape Juices: Quantification Using HPLC Approaches. Int J Mol Sci. 2016 Oct 24;17(10):1769. |
| Additional Infomation |
Trans-stilbene appears as off-white crystals. Melting point of 122-124 °C. Shows blue fluorescence. (NTP, 1992) Stilbene is an olefinic compound and a member of benzenes. trans-Stilbene has been reported in Alnus firma, Paeonia rockii, and other organisms with data available. Organic compounds that contain 1,2-diphenylethylene as a functional group. |
Solubility Data
| Solubility (In Vitro) | DMSO: 50 mg/mL (277.39 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (13.87 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 | 5.5479 mL | 27.7393 mL | 55.4785 mL | |
| 5 mM | 1.1096 mL | 5.5479 mL | 11.0957 mL | |
| 10 mM | 0.5548 mL | 2.7739 mL | 5.5479 mL |