Physicochemical Properties
| Molecular Formula | C₁₈H₃₄O₄ |
| Molecular Weight | 314.46 |
| Exact Mass | 314.245 |
| CAS # | 871-70-5 |
| PubChem CID | 70095 |
| Appearance | White to off-white solid powder |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 480.9±18.0 °C at 760 mmHg |
| Melting Point | 125°C |
| Flash Point | 258.8±17.7 °C |
| Vapour Pressure | 0.0±2.6 mmHg at 25°C |
| Index of Refraction | 1.474 |
| LogP | 6.11 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 17 |
| Heavy Atom Count | 22 |
| Complexity | 248 |
| Defined Atom Stereocenter Count | 0 |
| InChi Key | BNJOQKFENDDGSC-UHFFFAOYSA-N |
| InChi Code | InChI=1S/C18H34O4/c19-17(20)15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(21)22/h1-16H2,(H,19,20)(H,21,22) |
| Chemical Name | octadecanedioic acid |
| Synonyms | Octadecanedioic acid; Octadecanedioic 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
| References |
[1]. Tonsgard JH. Serum dicarboxylic acids in patients with Reye syndrome. J Pediatr. 1986 Sep;109(3):440-5. |
| Additional Infomation |
Octadecanedioic acid is an alpha,omega-dicarboxylic acid that is octadecane in which both terminal methyl groups have been replaced by carboxy groups. It is an alpha,omega-dicarboxylic acid and an octadecane. It is a conjugate acid of an octadecanedioate and an octadecanedioic acid anion. Octadecanedioic acid has been reported in Arabidopsis thaliana and Pinus radiata with data available. |
Solubility Data
| Solubility (In Vitro) | DMSO : ~100 mg/mL (~318.01 mM) |
| Solubility (In Vivo) |
Solubility in Formulation 1: 2.5 mg/mL (7.95 mM) in 10% DMSO + 40% PEG300 + 5% Tween80 + 45% 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 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 (7.95 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 | 3.1801 mL | 15.9003 mL | 31.8005 mL | |
| 5 mM | 0.6360 mL | 3.1801 mL | 6.3601 mL | |
| 10 mM | 0.3180 mL | 1.5900 mL | 3.1801 mL |