Physicochemical Properties
Molecular Formula | C1513CH32O2 |
Molecular Weight | 257.42 |
Exact Mass | 257.244 |
CAS # | 57677-53-9 |
Related CAS # | Palmitic acid;57-10-3;Palmitic acid sodium;408-35-5;Palmitic acid-1,2,3,4-13C4;287100-89-4 |
PubChem CID | 9881577 |
Appearance | White to off-white solid powder |
Density | 0.855 g/mL at 25ºC |
Boiling Point | 271.5ºC100 mm Hg(lit.) |
Melting Point | 61-64ºC(lit.) |
Index of Refraction | 1.454 |
LogP | 5.552 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 14 |
Heavy Atom Count | 18 |
Complexity | 178 |
Defined Atom Stereocenter Count | 0 |
SMILES | CCCCCCCCCCCCCCC[13C](=O)O |
InChi Key | IPCSVZSSVZVIGE-LOYIAQTISA-N |
InChi Code | InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)/i16+1 |
Chemical Name | (113C)hexadecanoic 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]. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-216. [2]. Antitumor activity of palmitic acid found as a selective cytotoxic substance in a marine red alga. Anticancer Res. 2002 Sep-Oct;22(5):2587-90. |
Solubility Data
Solubility (In Vitro) | DMSO : 66.67 mg/mL (258.99 mM) |
Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (9.71 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 | 3.8847 mL | 19.4235 mL | 38.8470 mL | |
5 mM | 0.7769 mL | 3.8847 mL | 7.7694 mL | |
10 mM | 0.3885 mL | 1.9424 mL | 3.8847 mL |