(Z)-3-hexen-1-yl propionate
cis-3-hexenyl propionate
Identification
| Name | (Z)-3-hexen-1-yl propionate |
| IUPAC | [(Z)-hex-3-enyl] propanoate |
| CAS Number | 33467-74-2 |
| EINECS | 251-533-2 |
| FDA UNII | Q6QY6N22M3 |
| Molecular Formula | C9 H16 O2 |
| Molecular Weight | 156.22492000 |
| MDL Number | MFCD00036534 |
| Nikkaji Number | J59.829A |
| Beilstein | 2076059 |
| CoE Number | 10683 |
Regulatory
| JECFA Food Flavoring | 1274 cis-3-hexenyl propionate |
| DG SANTE Food Flavourings | 09.564 hex-3(cis)-enyl propionate |
| FEMA Number | 3933 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 33467-74-2 ; (Z)-3-HEXENYL PROPIONATE |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 97.00 to 100.00 sum of isomers |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.88800 to 0.89200 @ 25.00 °C. |
| Pounds per Gallon - (est). | 7.389 to 7.422 |
| Refractive Index | 1.42800 to 1.43100 @ 20.00 °C. |
| Boiling Point | 180.00 to 182.00 °C. @ 760.00 mm Hg, 83.00 to 84.00 °C. @ 17.00 mm Hg |
| Vapor Pressure | 0.404000 mmHg @ 25.00 °C. (est) |
| Vapor Density | 5.3 ( Air = 1 ) |
| Flash Point | 140.00 °F. TCC ( 60.00 °C. ) |
| logP (o/w) | 2.909 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
| Similar Items | note |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Strength | medium , |
| Substantivity | > 4 hour(s) at 100.00 % |
| Odor Description |
at 10.00 % in dipropylene glycol. Green, fruity, apple and pear with a sweet, leafy nuance Sweet, powerful, intensely green odor that is vegetable-like and fatty with hints of tropical fruit Intensely green vegetable like with slightly fatty odor
|
| Odor sample from | Bedoukian Research, Inc. |
| Taste Description |
at 5.00 ppm. Excellent fresh, sweet green fruity note
|
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Oral/Parenteral Toxicity | oral-rat LD50 > 5000 mg/kg |
| Dermal Toxicity | skin-rabbit LD50 > 5000 mg/kg |
| 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 (Z)-3-hexen-1-yl propionate usage levels up to | 8.0000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 12.00 (μg/capita/day) |
| Maximised Survey-derived Daily Intakes (MSDI-USA) | 18.00 (μg/capita/day) |
| Modified Theoretical Added Maximum Daily Intake (mTAMDI) | ND (μg/person/day) |
| Threshold of Concern | 1800 (μg/person/day) |
| Structure Class | I |
| baked goods | 16.00000 |
| beverages(nonalcoholic) | - |
| beverages(alcoholic) | 4.00000 |
| breakfast cereal | - |
| cheese | - |
| chewing gum | 0.10000 |
| condiments / relishes | - |
| confectionery froastings | - |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | 7.00000 |
| fruit ices | - |
| gelatins / puddings | 4.00000 |
| granulated sugar | - |
| gravies | - |
| hard candy | 0.20000 |
| 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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