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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | (5-methyl-2-prop-1-en-2-ylcyclohexyl) acetate |
| InChI : | InChI=1/C12H20O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h9,11-12H,1,5-7H2,2-4H3 |
| InChIKey : | HLHIVJRLODSUCI-UHFFFAOYAN |
| SMILES : | CC1CCC(C(C1)OC(=O)C)C(=C)C |
| (EINECS) number : | 260-820-1 |
| cas number : | 57576-09-7 |
| fema number : | 2965 |
| coe number : | 2067 |
| jecfa number : | 756 |
| fl. number : | 09.219 |
| molar refractivity : | 56.89 ± 0.4 cm3 |
| parachor : | 485.9 ± 6.0 cm3 |
| index of refraction : | 1.458 ± 0.03 |
| surface tension : | 29.5 ± 5.0 dyne/cm |
| density : | 0.94 ± 0.1 g/cm3 |
| polarizability : | 22.55 ± 0.5 10-24cm3 |
| xlogp : | 3.10 |
| molecular weight : | 196.2860000 |
| formula : | C12 H20 O2 |
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| IUPAC name : | [(1R,2S,5R)-5-methyl-2-prop-1-en-2-ylcyclohexyl] acetate |
| InChI : | InChI=1/C12H20O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h9,11-12H,1,5-7H2,2-4H3/t9-,11+,12-/m1/s1 |
| InChIKey : | HLHIVJRLODSUCI-ADEWGFFLBC |
| SMILES : | C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C)C(=C)C |
| cas number : | 57576-09-7 |
| fema number : | 2965 |
| molar refractivity : | 56.89 ± 0.4 cm3 |
| parachor : | 485.9 ± 6.0 cm3 |
| index of refraction : | 1.458 ± 0.03 |
| surface tension : | 29.5 ± 5.0 dyne/cm |
| density : | 0.94 ± 0.1 g/cm3 |
| polarizability : | 22.55 ± 0.5 10-24cm3 |
| xlogp : | 3.10 |
| molecular weight : | 196.2860000 |
| formula : | C12 H20 O2 |
| BioActivity Analysis : | 474128 |
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| fda reg : | unspecified |
h. number : | 2915.39.9050 |
| organoleptics : | |
| odor type : | mentholic |
| odor strength : | medium |
odor description :
at 100.00 %. | woody sweet peppermint mint |
| taste description³ : | at 10.00 ppm.
Woody, berry, green and camphoreous with a fruity nuance |
| substantivity : | 24 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 95.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.92500 @ 25.00 °C.
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| refractive index : | 1.45600 @ 20.00 °C.
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| boiling point : | 104.00 - 105.00 °C. @ 10.00 mm Hg
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| boiling point : | 112.00 - 114.00 °C. @ 8.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| logp : | 4.38 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 186.00 °F. TCC ( 85.56 °C. )
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| recommendation for isopulegyl acetate usage levels up to : |
| | 8.0000 % in the fragrance concentrate.
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| recommendation for isopulegyl acetate usage levels up to : |
| | 25.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 260-820-1 |
| chemidplus : | 57576-09-7 |
| epa-srs : | 57576-09-7 |
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| chemidplus : | 057576097 |
| epa-srs : | 57576-09-7 |
| dtp/nci : | 403868 |
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| other : | |
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| references : | |
| pubchem : | 10527970 |
| NIST Chemistry WebBook : | 2899267442 |
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| pubchem : | 671690 |
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| reference : | Mosciano, Gerard P&F 19, No. 6, 53, (1994)³ |