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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| InChI : | InChI=1/C12H20O/c1-4-10-5-9-6-11(10)12(7-9)13-8(2)3/h4,8-9,11-12H,5-7H2,1-3H3/b10-4+ |
| InChIKey : | DFAHIMHECXLSIS-ONNFQVAWBM |
| (EINECS) number : | 292-041-8 |
| cas number : | 90530-04-4 |
| molar refractivity : | 54.85 ± 0.4 cm3 |
| parachor : | 447.6 ± 6.0 cm3 |
| index of refraction : | 1.485 ± 0.03 |
| surface tension : | 30.0 ± 5.0 dyne/cm |
| density : | 0.94 ± 0.1 g/cm3 |
| polarizability : | 21.74 ± 0.5 10-24cm3 |
| molecular weight : | 180.2866000 |
| formula : | C12 H20 O |
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| export tariff code : | 2909.20 |
| fda reg : | unspecified |
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Suppliers :
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| International Flavors & Fragrances : | Isoproxen |
| | ≥99% (sum of isomers) |
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organoleptics :
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| odor type : | herbal |
| odor strength : | medium |
odor description :
at 100.00 %. | herbal citrus licorice petitgrain animal costus |
| substantivity : | 12 hour(s) at 100.00 % |
properties :
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| appearence : | colorless to pale yellow clear liquid |
| assay : | 99.00 - 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.90200 - 0.91000 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.506 to 7.572
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| specific gravity : | 0.90300 - 0.91100 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.523 to 7.589
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| refractive index : | 1.46200 - 1.46800 @ 20.00 °C.
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| boiling point : | 230.00 - 231.00 °C. @ 760.00 mm Hg
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| logp : | 3.41 |
safety :
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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. ) : | 165.00 °F. TCC ( 73.89 °C. )
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| recommendation for petitgrain heptane usage levels up to : |
| | 5.0000 % in the fragrance concentrate.
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| recommendation for petitgrain heptane usage levels up to : |
| | not for flavor use.
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safety links :
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| (EINECS) number : | 292-041-8 |
| chemidplus : | 090530044 |
| epa-srs : | 90530-04-4 |
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other :
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references :
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| pubchem : | 3785659 |
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