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| IUPAC name : | hepta-2,4-dien-1-ol |
| InChI : | InChI=1/C7H12O/c1-2-3-4-5-6-7-8/h3-6,8H,2,7H2,1H3 |
| InChIKey : | MDRZSADXFOPYOC-UHFFFAOYAM |
| SMILES : | CCC=CC=CCO |
| cas number : | 62488-55-5 |
| fema number : | 4127 |
| molar refractivity : | 36.12 ± 0.3 cm3 |
| parachor : | 301.7 ± 4.0 cm3 |
| index of refraction : | 1.472 ± 0.02 |
| surface tension : | 30.1 ± 3.0 dyne/cm |
| density : | 0.870 ± 0.06 g/cm3 |
| polarizability : | 14.32 ± 0.5 10-24cm3 |
| xlogp : | 1.80 |
| molecular weight : | 112.1695800 |
| formula : | C7 H12 O |
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| IUPAC name : | (2E,4E)-hepta-2,4-dien-1-ol |
| InChI : | InChI=1/C7H12O/c1-2-3-4-5-6-7-8/h3-6,8H,2,7H2,1H3/b4-3+,6-5+ |
| InChIKey : | MDRZSADXFOPYOC-VNKDHWASBN |
| SMILES : | CC\C=C\C=C\CO |
| (EINECS) number : | 251-535-3 |
| cas number : | 33467-79-7 |
| fema number : | 4127 |
| jecfa number : | 1784 |
| fl. number : | 02.153 |
| molar refractivity : | 36.12 ± 0.3 cm3 |
| parachor : | 301.7 ± 4.0 cm3 |
| index of refraction : | 1.472 ± 0.02 |
| surface tension : | 30.1 ± 3.0 dyne/cm |
| density : | 0.870 ± 0.06 g/cm3 |
| polarizability : | 14.32 ± 0.5 10-24cm3 |
| xlogp : | 1.80 |
| molecular weight : | 112.1695800 |
| formula : | C7 H12 O |
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| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor type : | fatty |
| odor strength : | medium ,
recommend smelling in a 1.00 % solution or less |
odor description :
at 1.00 % in dipropylene glycol. | green fruity nutty cheese |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 95.00 - 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.87700 - 0.88100 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.298 to 7.331
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| refractive index : | 1.48700 - 1.49300 @ 20.00 °C.
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| boiling point : | 68.00 °C. @ 0.50 mm Hg
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| boiling point : | 80.00 °C. @ 14.00 mm Hg
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| logp : | 1.77 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 175.00 °F. TCC ( 79.44 °C. )
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| recommendation for (E,E)-2,4-heptadien-1-ol usage levels up to : |
| | 0.5000 % in the fragrance concentrate.
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| Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). |
| publication number : 22. |
| 4127 | average usual ppm | average maximum ppm |
| baked goods : | 10.00000 | 50.00000 |
| beverages(nonalcoholic) : | 5.00000 | 25.00000 |
| beverages(alcoholic) : | - | - |
| breakfast cereal : | 5.00000 | 25.00000 |
| cheese : | 7.00000 | 35.00000 |
| chewing gum : | - | - |
| condiments / relishes : | 5.00000 | 25.00000 |
| confectionery froastings : | 10.00000 | 50.00000 |
| egg products : | - | - |
| fats / oils : | 5.00000 | 25.00000 |
| fish products : | 2.00000 | 10.00000 |
| frozen dairy : | 7.00000 | 35.00000 |
| fruit ices : | 10.00000 | 50.00000 |
| gelatins / puddings : | 5.00000 | 25.00000 |
| granulated sugar : | - | - |
| gravies : | 20.00000 | 100.00000 |
| hard candy : | - | - |
| imitation dairy : | 7.00000 | 35.00000 |
| instant coffee / tea : | - | - |
| jams / jellies : | 5.00000 | 25.00000 |
| meat products : | 2.00000 | 10.00000 |
| milk products : | 7.00000 | 35.00000 |
| nut products : | - | - |
| other grains : | 5.00000 | 25.00000 |
| poultry : | 2.00000 | 10.00000 |
| processed fruits : | 7.00000 | 35.00000 |
| processed vegetables : | - | - |
| reconstituted vegetables : | - | - |
| seasonings / flavors : | 5.00000 | 25.00000 |
| snack foods : | 10.00000 | 50.00000 |
| soft candy : | - | - |
| soups : | 5.00000 | 25.00000 |
| sugar substitutes : | - | - |
| sweet sauces : | 5.00000 | 25.00000 |
| safety links : | |
| chemidplus : | 62488-55-5 |
| epa-srs : | 62488-55-5 |
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| (EINECS) number : | 251-535-3 |
| chemidplus : | 033467797 |
| epa-srs : | 33467-79-7 |
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| other : | |
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| references : | |
| pubchem : | 29299551 |
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| jecfa number : | 1784 |
| fl. number : | 02.153 |
| pubchem : | 695171 |
| NIST Chemistry WebBook : | 3175199796 |
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