methyl 4-methyl valerate
methyl 4-methylvalerate
Identification
| Name | methyl 4-methyl valerate |
| IUPAC | methyl 4-methylpentanoate |
| CAS Number | 2412-80-8 |
| EINECS | 219-320-9 |
| FDA UNII | J4R2BY5GJT |
| Molecular Formula | C7 H14 O2 |
| Molecular Weight | 130.18698000 |
| MDL Number | MFCD00191236 |
| Nikkaji Number | J144.104C |
| CoE Number | 322 |
| XlogP3 | 2.10 (est) |
Regulatory
| JECFA Food Flavoring | 216 methyl 4-methylvalerate |
| DG SANTE Food Flavourings | 09.432 methyl 4-methylvalerate |
| FEMA Number | 2721 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 2412-80-8 ; METHYL 4-METHYLVALERATE |
| FDA Regulation | FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 97.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.88800 @ 25.00 °C. |
| Refractive Index | 1.40400 @ 20.00 °C. |
| Boiling Point | 139.00 to 140.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 7.853000 mmHg @ 25.00 °C. (est) |
| Flash Point | 103.00 °F. TCC ( 39.44 °C. ) |
| logP (o/w) | 2.158 (est) |
| Soluble in | alcohol |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Description |
at 10.00 % in dipropylene glycol. Fruity, sweet, banana, pineapple, with cheese-like nuances
|
| Taste Description | at 50.00 ppm. |
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| 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 methyl 4-methyl valerate usage levels up to | 0.5000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 0.024 (μg/capita/day) |
| 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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Potential Uses
Natural Occurrence
Synonyms
banana valerate
methyl 4-methyl pentanoate
methyl 4-methyl valerate
methyl 4-methylpentanoate
methyl 4-methylvalerate
methyl isobutyl acetate
methyl isobutylacetate
methyl isocaproate
methyl isohexanoate
methyl methyl valerate
4-
methyl pentanoic acid methyl ester
4-
methyl valeric acid methyl ester
methyl-4-methyl valerate
pentanoic acid, 4-methyl-, methyl ester
valeric acid, 4-methyl-, methyl ester
Info:
Volatile Flavor Components in Bogyojosaeng and Suhong Cultivars of Strawberry (Fragaria ananassa Duch.)