| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | pentadecanoic acid |
| InChI : | InChI=1/C15H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17/h2-14H2,1H3,(H,16,17) |
| InChIKey : | WQEPLUUGTLDZJY-UHFFFAOYAK |
| SMILES : | CCCCCCCCCCCCCCC(=O)O |
| (EINECS) number : | 213-693-1 |
| cas number : | 1002-84-2 |
| beilstein number : | 1773831 |
| fema number : | 4334 |
| molar refractivity : | 73.10 ± 0.3 cm3 |
| parachor : | 650.7 ± 4.0 cm3 |
| index of refraction : | 1.452 ± 0.02 |
| surface tension : | 33.3 ± 3.0 dyne/cm |
| density : | 0.865 ± 0.06 g/cm3 |
| polarizability : | 28.98 ± 0.5 10-24cm3 |
| xlogp : | 5.70 |
| molecular weight : | 242.3975000 |
| formula : | C15 H30 O2 |
| BioActivity Analysis : | 88472 |
|
|
| |
| |
| export tariff code : | 2915.90.1050 |
| fda reg : | unspecified |
| |
Suppliers :
|
| Sigma-Aldrich-Aldrich : | Pentadecanoic acid
≥99% |
organoleptics :
|
| odor strength : | medium |
odor description : at 100.00 %. | waxy |
properties :
|
| appearence : | white solid |
| assay : | 99.00 to 100.00 %
|
| Food Chemicals Codex Listed : | No |
| melting point : | 51.00 to 53.00 °C. @ 760.00 mm Hg
|
| boiling point : | 257.00 °C. @ 100.00 mm Hg
|
| boiling point : | 339.00 to 340.00 °C. @ 760.00 mm Hg
|
| logp : | 6.47 |
safety :
|
| most important hazard(s) : |
Xi - Irritant |
| Oral Toxicity(LD50) : |
Not determined
|
| Dermal Toxicity(LD50) : |
Not determined
|
| flash point ( Deg. F. ) : | 235.00 °F. TCC ( 112.78 °C. )
|
| recommendation for pentadecanoic acid usage levels up to : |
| | 5.0000 % in the fragrance concentrate.
|
| |
| Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). |
| publication number : 23. |
| | average usual ppm | average maximum ppm |
| baked goods : | 0.50000 | 5.00000 |
| beverages(nonalcoholic) : | - | - |
| beverages(alcoholic) : | - | - |
| breakfast cereal : | - | - |
| cheese : | - | - |
| chewing gum : | - | - |
| condiments / relishes : | - | - |
| confectionery froastings : | - | - |
| egg products : | - | - |
| fats / oils : | 1.00000 | 5.00000 |
| fish products : | - | - |
| frozen dairy : | - | - |
| fruit ices : | - | - |
| gelatins / puddings : | - | - |
| granulated sugar : | - | - |
| gravies : | - | - |
| hard candy : | - | - |
| imitation dairy : | 0.20000 | 1.00000 |
| instant coffee / tea : | - | - |
| jams / jellies : | - | - |
| meat products : | - | - |
| milk products : | 0.10000 | 0.50000 |
| nut products : | - | - |
| other grains : | - | - |
| poultry : | - | - |
| processed fruits : | - | - |
| processed vegetables : | - | - |
| reconstituted vegetables : | - | - |
| seasonings / flavors : | 1.00000 | 5.00000 |
| snack foods : | 0.20000 | 1.00000 |
| soft candy : | - | - |
| soups : | - | - |
| sugar substitutes : | - | - |
| sweet sauces : | - | - |
safety references :
|
| EPI System : | view |
| |
| |
| | pentadecanoic acid
|
| (EINECS) number : | 213-693-1 |
| RTECS : | RZ1925000 for 1002-84-2 |
| chemidplus : | 001002842 |
| EPA Substance Registry Services : | 1002-84-2 |
| NLM Chemical Carcinogenesis Research Information System : | 1002-84-2 |
| NLM Developmental and Reproductive Toxicity : | 1002-84-2 |
| NLM Env. Mutagen Info. Center : | 1002-84-2 |
| NLM GENetic TOXicology : | 1002-84-2 |
references :
|
| | pentadecanoic acid
|
| pubchem : | 157173 |
| NIST Chemistry WebBook : | 3775002218 |
other :
|