heptanoic acid
oenanthic acid
Identification
| Name | heptanoic acid |
| IUPAC | heptanoic acid |
| CAS Number | 111-14-8 |
| EINECS | 203-838-7 |
| FDA UNII | THE3YNP39D |
| Molecular Formula | C7 H14 O2 |
| Molecular Weight | 130.18698000 |
| MDL Number | MFCD00004426 |
| Nikkaji Number | J1.985B |
| Beilstein | 1744723 |
| CoE Number | 28 |
| XlogP3 | 2.50 (est) |
Regulatory
| JECFA Food Flavoring | 96 heptanoic acid |
| DG SANTE Food Flavourings | 08.028 heptanoic acid |
| DG SANTE Food Contact Materials | heptanoic acid |
| FEMA Number | 3348 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 111-14-8 ; HEPTANOIC ACID |
| FDA Regulation | FDA PART 173 -- SECONDARY DIRECT FOOD ADDITIVES PERMITTED IN FOOD FOR HUMAN CONSUMPTION |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 97.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.91000 to 0.93000 @ 25.00 °C. |
| Pounds per Gallon - (est). | 7.572 to 7.739 |
| Refractive Index | 1.41700 to 1.42700 @ 20.00 °C. |
| Melting Point | -11.00 to -9.00 °C. @ 760.00 mm Hg |
| Boiling Point | 222.00 to 223.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 0.058000 mmHg @ 25.00 °C. (est) |
| Vapor Density | 4.4 ( Air = 1 ) |
| Flash Point | > 230.00 °F. TCC ( > 110.00 °C. ) |
| logP (o/w) | 2.420 |
| Soluble in | alcohol |
| Insoluble in | water |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Description |
at 1.00 % in propylene glycol. Cheesy, waxy, sweaty, fermented, pineapple and fruity BITTER, RANCID, SWEATY
|
| Taste Description | at 5.00 ppm. |
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Oral/Parenteral Toxicity | oral-rat LD50 7000 mg/kg |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | flavor and fragrance agents |
| RIFM Fragrance Material Safety Assessment | Search |
| Structure Class | I |
| baked goods | - |
| beverages(nonalcoholic) | - |
| beverages(alcoholic) | - |
| breakfast cereal | - |
| cheese | - |
| chewing gum | - |
| condiments / relishes | - |
| confectionery froastings | - |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | - |
| fruit ices | - |
| gelatins / puddings | - |
| granulated sugar | - |
| gravies | - |
| hard candy | - |
| imitation dairy | - |
| instant coffee / tea | - |
| jams / jellies | - |
| meat products | - |
| milk products | - |
| nut products | - |
| other grains | - |
| poultry | - |
| processed fruits | - |
| processed vegetables | - |
| reconstituted vegetables | - |
| seasonings / flavors | - |
| snack foods | - |
| soft candy | - |
| soups | - |
| sugar substitutes | - |
| sweet sauces | - |
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