nonyl isovalerate
isovaleric acid, nonyl ester
Identification
| Name | nonyl isovalerate |
| IUPAC | nonyl 3-methylbutanoate |
| CAS Number | 7786-47-2 |
| EINECS | 232-098-8 |
| FDA UNII | SXP0UF66RQ |
| Molecular Formula | C14 H28 O2 |
| Molecular Weight | 228.37556000 |
| MDL Number | MFCD00672796 |
| Nikkaji Number | J183.051A |
| CoE Number | 447 |
| XlogP3 | 5.20 (est) |
Regulatory
| JECFA Food Flavoring | 201 nonyl isovalerate |
| DG SANTE Food Flavourings | 09.452 nonyl isovalerate |
| FEMA Number | 2791 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 7786-47-2 ; NONYL ISOVALERATE |
| FDA Regulation | FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 98.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Boiling Point | 264.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 0.009000 mmHg @ 25.00 °C. (est) |
| Flash Point | 239.00 °F. TCC ( 115.00 °C. ) |
| logP (o/w) | 5.724 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
| Similar Items | note |
Organoleptic Properties
| Odor Description | at 100.00 %. |
Safety Information
| Oral/Parenteral Toxicity | Not determined |
| 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 |
| Recommendation for nonyl isovalerate usage levels up to | 1.0000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 0.012 (μg/capita/day) |
| baked goods | - |
| beverages(nonalcoholic) | 0.50000 |
| 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 | 1.00000 |
| 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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Potential Uses
Natural Occurrence
Synonyms
butanoic acid, 3-methyl-, nonyl ester
3-
methyl butanoic acid nonyl ester
nonyl 3-methyl butanoate
nonyl 3-methylbutanoate
nonyl isopentanoate
nonyl isovalerianate
iso
valeric acid nonyl ester
iso
valeric acid, nonyl ester
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