| CAS Number: | 28316-62-3 | 3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 248-960-1 |
| FDA UNII: | 2EEE2O3TE8 |
| CoE Number: | 10889 |
| XlogP3-AA: | 4.50 (est) |
| Molecular Weight: | 210.31674000 |
| Formula: | C13 H22 O2 |
| NMR Predictor: | Predict (works with chrome or firefox) |
| EFSA/JECFA Comments: | Only (2E,4Z)-isomer (EFFA, 2010a). The Register name to be changed accordingly.
[FL-no: 09.287] should be deleted from the UL as this substance is covered by [FL-no: 09.840] (Documentation provided to EFSA n.7), provided that the compositions of the mixtures of stereoisomers for these two substances are the same |
Category: flavoring agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Physical Properties:
| Assay: | 95.00 to 100.00 %
|
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.91300 to 0.91900 @ 25.00 °C.
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| Pounds per Gallon - (est).: | 7.597 to 7.647
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| Refractive Index: | 1.46800 to 1.47500 @ 20.00 °C.
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| Boiling Point: | 276.00 to 278.00 °C. @ 760.00 mm Hg
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| Vapor Pressure: | 0.003000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 262.00 °F. TCC ( 127.78 °C. )
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| logP (o/w): | 4.963 (est) |
| Soluble in: |
| | alcohol | | | water, 2.769 mg/L @ 25 °C (est) |
| Insoluble in: |
| | water |
Organoleptic Properties:
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| Odor and/or flavor descriptions from others (if found). |
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Cosmetic Information:
Suppliers:
Safety Information:
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| Hazards identification |
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| Classification of the substance or mixture |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) |
| None found. |
| GHS Label elements, including precautionary statements |
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| Pictogram | |
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| Hazard statement(s) |
| None found. |
| Precautionary statement(s) |
| None found. |
| Oral/Parenteral Toxicity: |
|
Not determined
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| Dermal Toxicity: |
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Not determined
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| Inhalation Toxicity: |
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Not determined
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Safety in Use Information:
| Category: | flavoring agents |
| Recommendation for propyl (E,Z)-2,4-decadienoate usage levels up to: | | | not for fragrance use.
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| |
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 0.61 (μg/capita/day) |
| Threshold of Concern: | 1800 (μg/person/day) |
| Structure Class: | I |
Safety References:
| Flavor & Extract Manufacturers Association (FEMA) reference(s): |
| The FEMA GRAS assessment of alpha,beta-unsaturated aldehydes and related substances used as flavor ingredients. View pdf |
| European Food Safety Athority(EFSA): | Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| European Food Safety Authority (EFSA) reference(s): |
Scientific Opinion on Flavouring Group Evaluation 71: Consideration of aliphatic, linear, alpha,beta-unsaturated carboxylic acids and related esters View page or View pdf |
Flavouring Group Evaluation 72 (FGE.72): Consideration of aliphatic, branched-chain saturated and unsaturated alcohols, aldehydes, acids, and related esters evaluated by the JECFA (61st meeting) structurally related to branched- and straight-chain unsaturated carboxylic acids. Esters of these and straight-chain aliphatic saturated alcohols evaluated by EFSA in FGE.05Rev2 (2010) View page or View pdf |
Flavouring Group Evaluation 5, Revision 2 (FGE.05Rev2): Branched- and straight-chain unsaturated carboxylic acids and esters of these with aliphatic saturated alcohols from chemical groups 1, 2, 3 and 5 View page or View pdf |
Scientific Opinion on Flavouring Group Evaluation 5, Revision 3 (FGE.05Rev3): Branched- and straight-chain unsaturated aldehydes, dienals, unsaturated and saturated carboxylic acids and related esters with saturated and unsaturated aliphatic alcohols and a phenylacetic acid related ester from chemical groups 1, 2, 3, 5 and 15 View page or View pdf |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 6438200 |
| National Institute of Allergy and Infectious Diseases: | Data |
| | propyl (2E,4Z)-deca-2,4-dienoate |
| Chemidplus: | 0028316623 |
References:
Other Information:
Potential Blenders and core components note
| |
| For Odor |
| animal |
| | methyl (E)-2-octenoate | FL/FR |
| fermented |
| | hexanal diethyl acetal | FL/FR |
| floral |
| | hexyl 2-furoate | FL/FR |
| fruity |
| iso | amyl butyrate | FL/FR |
| | amyl hexanoate | FL/FR |
| | apple crotonate | FR |
| | butyl isovalerate | FL/FR |
| | ethyl (E)-2-decenoate | FL/FR |
| | ethyl (E)-4-octenoate | FR |
| | ethyl 2-cyclohexyl propionate | FR |
| | ethyl cyclohexane propionate | FL/FR |
| (E)-3- | hexen-1-yl acetate | FL/FR |
| (Z)-3- | hexen-1-yl isobutyrate | FL/FR |
| 2- | hexenyl cyclopentanyl acetate | FR |
| | hexyl (E)-tiglate | FL/FR |
| | hexyl propionate | FL/FR |
| | linalyl hexanoate | FL/FR |
| 3- | mercaptohexyl acetate | FL/FR |
| | methyl (E,Z)-2,4-decadienoate | FL/FR |
| | methyl 2-octenoate | FL/FR |
| | methyl 3-nonenoate | FL/FR |
| | methyl nonanoate | FL/FR |
| | nerolidyl isobutyrate | FR |
| (Z)-3- | octen-1-yl propionate | FL/FR |
| | pear valerate | FR |
| | propyl acetate | FL/FR |
| | propyl heptanoate | FL/FR |
| iso | propyl isobutyrate | FL/FR |
| green |
| | acetaldehyde methyl hexyl acetal | FR |
| | ethyl (E,Z)-2,4-decadienoate | FL/FR |
| | heptyl acetate | FL/FR |
| (Z)-3- | hexen-1-yl (Z)-3-hexenoate | FL/FR |
| (Z)-3- | hexen-1-yl acetate | FL/FR |
| (Z)-3- | hexen-1-yl hexanoate | FL/FR |
| (E)-2- | hexen-1-yl isovalerate | FL/FR |
| (Z)-3- | hexen-1-yl propionate | FL/FR |
| (E)-2- | hexen-1-yl propionate | FL/FR |
| (Z)-3- | hexen-1-yl valerate | FL/FR |
| | hexyl isobutyrate | FL/FR |
| | manzanate (Givaudan) | FL/FR |
| | melon nonenoate | FL/FR |
| (E,Z)-3,6- | nonadien-1-yl acetate | FL/FR |
| 3,6- | nonadien-1-yl acetate | FL/FR |
| | sorbyl isobutyrate | FL/FR |
| herbal |
| | dill seed oil indian | FL/FR |
| melon |
| | melon carboxaldehyde | FR |
| (Z)-6- | nonen-1-yl acetate | FL/FR |
| | watermelon ketone | FR |
| minty |
| laevo- | carveol | FL/FR |
| laevo- | carvone | FL/FR |
| cis- | carvone-5,6-oxide | FL/FR |
| | carvyl acetate | FL/FR |
| | dihydrocarveol | FL/FR |
| dextro- | dihydrocarvone | FL/FR |
| | spearmint absolute | FL/FR |
| | spearmint oil america | FL/FR |
| | spearmint oil terpeneless | FL/FR |
| | tetrahydrocarvone | FL/FR |
| musk |
| | musk propanoate | FR |
| spicy |
| trans- | carveol | FL/FR |
| tonka |
| | mint lactone | FL/FR |
| tropical |
| | ethyl (Z)-3-hexenoate | FL/FR |
| waxy |
| | ethyl octanoate | FL/FR |
| 2,4- | nonadien-1-ol | FL/FR |
| (Z)-3- | nonen-1-ol | FL/FR |
| (E)-2- | tridecen-1-yl acetate | FL/FR |
| |
| For Flavor |
| |
| No flavor group found for these |
| laevo- | carveol | FL/FR |
| trans- | carveol | FL/FR |
| | ethyl (Z)-3-hexenoate | FL/FR |
| | ethyl cyclohexane propionate | FL/FR |
| | hexanal diethyl acetal | FL/FR |
| | hexyl propionate | FL/FR |
| | linalyl hexanoate | FL/FR |
| cis+trans-para-1(7)8- | menthadien-2-yl acetate | FL |
| | methyl (E,Z)-2,4-decadienoate | FL/FR |
| | methyl 2-octenoate | FL/FR |
| iso | propyl isobutyrate | FL/FR |
| (E)-2- | tridecen-1-yl acetate | FL/FR |
|
| | sorbyl isobutyrate | FL/FR |
| cooling |
| | manzanate (Givaudan) | FL/FR |
| creamy |
| | mint lactone | FL/FR |
| estery |
| | propyl acetate | FL/FR |
| fatty |
| 2,4- | nonadien-1-ol | FL/FR |
| fruity |
| | amyl hexanoate | FL/FR |
| | butyl isovalerate | FL/FR |
| | ethyl (E)-2-decenoate | FL/FR |
| (E)-3- | hexen-1-yl acetate | FL/FR |
| (Z)-3- | hexen-1-yl isobutyrate | FL/FR |
| | methyl (E)-2-octenoate | FL/FR |
| | methyl (E)-3-nonenoate | FL |
| | methyl 3-nonenoate | FL/FR |
| (Z)-3- | octen-1-yl propionate | FL/FR |
| green |
| | dihydrocarveol | FL/FR |
| dextro- | dihydrocarvone | FL/FR |
| | ethyl (E,Z)-2,4-decadienoate | FL/FR |
| | heptyl acetate | FL/FR |
| (Z)-3- | hexen-1-yl (Z)-3-hexenoate | FL/FR |
| (Z)-3- | hexen-1-yl acetate | FL/FR |
| (Z)-3- | hexen-1-yl hexanoate | FL/FR |
| (E)-2- | hexen-1-yl isovalerate | FL/FR |
| (Z)-3- | hexen-1-yl propionate | FL/FR |
| (E)-2- | hexen-1-yl propionate | FL/FR |
| (Z)-3- | hexen-1-yl valerate | FL/FR |
| | hexyl (E)-tiglate | FL/FR |
| | hexyl 2-furoate | FL/FR |
| | hexyl isobutyrate | FL/FR |
| | melon nonenoate | FL/FR |
| 3,6- | nonadien-1-yl acetate | FL/FR |
| (E,Z)-3,6- | nonadien-1-yl acetate | FL/FR |
| (Z)-6- | nonen-1-yl acetate | FL/FR |
| (E,E)-2,4- | octadienal | FL |
| 2,4- | octadienal | FL |
| minty |
| laevo- | carvone | FL/FR |
| cis- | carvone-5,6-oxide | FL/FR |
| | carvyl acetate | FL/FR |
| | spearmint absolute | FL/FR |
| | spearmint oil america | FL/FR |
| | spearmint oil terpeneless | FL/FR |
| | tetrahydrocarvone | FL/FR |
| spicy |
| | dill seed oil indian | FL/FR |
| tropical |
| 3- | mercaptohexyl acetate | FL/FR |
| waxy |
| iso | amyl butyrate | FL/FR |
| | ethyl octanoate | FL/FR |
| (Z)-3- | nonen-1-ol | FL/FR |
| | propyl heptanoate | FL/FR |
| winey |
| | methyl nonanoate | FL/FR |
| |
Potential Uses:
Occurrence (nature, food, other): note
Synonyms:
| (2E,4Z)- | decadienoic acid propyl ester | | (E,Z)-2,4- | decadienoic acid propyl ester | | 2,4- | decadienoic acid, propyl ester, (2E,4Z)- | | 2,4- | decadienoic acid, propyl ester, (E,Z)- | | | propyl (2E,4Z)-2,4-decadienoate | | | propyl (2E,4Z)-deca-2,4-dienoate | | (E,Z)- | propyl 2,4-decadienoate | | | propyl trans,cis-2,4-decadienoate | | | propyl trans-2,cis-4-decadienoate |
Articles:
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