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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | 3-methyl-4-(2,2,6-trimethylcyclohexyl)butan-2-ol |
| InChI : | InChI=1/C14H28O/c1-10-7-6-8-14(4,5)13(10)9-11(2)12(3)15/h10-13,15H,6-9H2,1-5H3 |
| InChIKey : | HMENPFAAAQWASO-UHFFFAOYAN |
| SMILES : | CC1CCCC(C1CC(C)C(C)O)(C)C |
| (EINECS) number : | 262-117-5 |
| cas number : | 60241-53-4 |
| molar refractivity : | 66.37 ± 0.3 cm3 |
| parachor : | 577.5 ± 4.0 cm3 |
| index of refraction : | 1.443 ± 0.02 |
| surface tension : | 28.3 ± 3.0 dyne/cm |
| density : | 0.848 ± 0.06 g/cm3 |
| polarizability : | 26.31 ± 0.5 10-24cm3 |
| xlogp : | 5.70 |
| molecular weight : | 212.3715200 |
| formula : | C14 H28 O |
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| fda reg : | unspecified |
h. number : | 2906.19.5000 |
| organoleptics : | |
| odor type : | woody |
| odor strength : | medium |
odor description :
at 100.00 %. | woody violet |
| properties : | |
| appearence : | colorless to pale yellow clear liquid |
| assay : | 96.00 - 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.91000 - 0.92000 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.572 to 7.655
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| refractive index : | 1.47000 - 1.48500 @ 20.00 °C.
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| boiling point : | 125.00 °C. @ 3.00 mm Hg
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| boiling point : | 101.00 - 103.00 °C. @ 0.80 mm Hg
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| logp : | 5.20 |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
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| Oral Toxicity(LD50) : |
Oral-Rat >2000.00 mg/kg
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| Dermal Toxicity(LD50) : |
Skin-Rabbit >2000.00 mg/kg
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| flash point ( Deg. F. ) : | 230.00 °F. TCC ( 110.00 °C. )
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| recommendation for violet propanol usage levels up to : |
| | 6.0000 % in the fragrance concentrate.
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| recommendation for violet propanol usage levels up to : |
| | not for flavor use.
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| safety links : | |
| (EINECS) number : | 262-117-5 |
| chemidplus : | 060241534 |
| epa-srs : | 60241-53-4 |
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| other : | |
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| references : | |
| pubchem : | 685780 |
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