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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | (E)-1-(2,6,6-trimethyl-1-cyclohexenyl)pent-1-en-3-ol |
| InChI : | InChI=1/C14H24O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h8-9,12,15H,5-7,10H2,1-4H3/b9-8+ |
| InChIKey : | DZSNHSUUMHDJRJ-CMDGGOBGBV |
| SMILES : | CCC(\C=C\C1=C(CCCC1(C)C)C)O |
| (EINECS) number : | 298-957-4 |
| cas number : | 93840-90-5 |
| molar refractivity : | 67.80 ± 0.3 cm3 |
| parachor : | 540.2 ± 6.0 cm3 |
| index of refraction : | 1.525 ± 0.02 |
| surface tension : | 35.7 ± 3.0 dyne/cm |
| density : | 0.943 ± 0.06 g/cm3 |
| polarizability : | 26.87 ± 0.5 10-24cm3 |
| xlogp : | 4.10 |
| molecular weight : | 208.3397600 |
| formula : | C14 H24 O |
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| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor type : | fruity |
| odor strength : | medium |
odor description :
at 100.00 %. | berry |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 50.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.91000 - 0.93000 @ 100.00 °C.
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| pounds per gallon - calc. : | 7.572 to 7.739
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| refractive index : | 1.48500 - 1.50500 @ 20.00 °C.
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| boiling point : | 72.00 °C. @ 2.00 mm Hg
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| boiling point : | 298.00 - 299.00 °C. @ 760.00 mm Hg
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| logp : | 4.86 |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
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| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 210.00 °F. TCC ( 98.89 °C. )
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| recommendation for methyl beta-ionol usage levels up to : |
| | 3.0000 % in the fragrance concentrate.
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| safety links : | |
| (EINECS) number : | 298-957-4 |
| chemidplus : | 093840905 |
| epa-srs : | 93840-90-5 |
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| other : | |
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| references : | |
| pubchem : | 752765 |
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