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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | 2,2-dimethyl-3-(3-methylphenyl)propan-1-ol |
| InChI : | InChI=1/C12H18O/c1-10-5-4-6-11(7-10)8-12(2,3)9-13/h4-7,13H,8-9H2,1-3H3 |
| InChIKey : | FYMOBFDUZIDKMI-UHFFFAOYAH |
| SMILES : | CC1=CC(=CC=C1)CC(C)(C)CO |
| (EINECS) number : | 403-140-4 |
| cas number : | 103694-68-4 |
| molar refractivity : | 56.02 ± 0.3 cm3 |
| parachor : | 452.6 ± 4.0 cm3 |
| index of refraction : | 1.515 ± 0.02 |
| surface tension : | 35.3 ± 3.0 dyne/cm |
| density : | 0.960 ± 0.06 g/cm3 |
| polarizability : | 22.21 ± 0.5 10-24cm3 |
| xlogp : | 2.90 |
| molecular weight : | 178.2707200 |
| formula : | C12 H18 O |
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| fda reg : | unspecified |
h. number : | unspecified |
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| organoleptics : | |
| odor type : | floral |
| odor strength : | medium |
odor description :
at 100.00 %. | fresh soft floral lily of the valley green fruity |
| substantivity : | 400 Hour(s) |
| properties : | |
| appearence : | colorless to pale yellow clear oily liquid |
| assay : | 97.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.95500 - 0.96500 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.947 to 8.030
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| refractive index : | 1.51150 - 1.52150 @ 20.00 °C.
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| melting point : | 22.00 °C. @ 760.00 mm Hg
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| boiling point : | 275.00 - 276.00 °C. @ 760.00 mm Hg
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| logp : | 3.04 |
| safety : | |
| Oral Toxicity(LD50) : |
Oral-Rat >2000.00 mg/kg
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | > 200.00 °F. TCC ( > 93.33 °C. )
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| recommendation for lily propanol usage levels up to : |
| | 8.0000 % in the fragrance concentrate.
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| recommendation for lily propanol usage levels up to : |
| | not for flavor use.
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| safety links : | |
| (EINECS) number : | 403-140-4 |
| chemidplus : | 103694684 |
| epa-srs : | 103694-68-4 |
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| other : | |
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| references : | |
| pubchem : | 753147 |
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