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| IUPAC name : | 3-methyl-5-phenylpentan-1-ol |
| InChI : | InChI=1/C12H18O/c1-11(9-10-13)7-8-12-5-3-2-4-6-12/h2-6,11,13H,7-10H2,1H3 |
| InChIKey : | OXYRENDGHPGWKV-UHFFFAOYAA |
| SMILES : | CC(CCC1=CC=CC=C1)CCO |
| (EINECS) number : | 259-461-3 |
| cas number : | 55066-48-3 |
| molar refractivity : | 55.82 ± 0.3 cm3 |
| parachor : | 457.1 ± 4.0 cm3 |
| index of refraction : | 1.511 ± 0.02 |
| surface tension : | 36.3 ± 3.0 dyne/cm |
| density : | 0.957 ± 0.06 g/cm3 |
| polarizability : | 22.13 ± 0.5 10-24cm3 |
| xlogp : | 3.40 |
| molecular weight : | 178.2707200 |
| formula : | C12 H18 O |
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| fda reg : | unspecified |
h. number : | 2906.29.0000 |
| organoleptics : | |
| odor type : | floral |
| odor strength : | medium |
odor description :
at 100.00 %. | fresh floral rose absolute |
| substantivity : | 400 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 97.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.95400 - 0.96200 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.938 to 8.005
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| specific gravity : | 0.95500 - 0.96300 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.956 to 8.022
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| refractive index : | 1.50900 - 1.51400 @ 20.00 °C.
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| boiling point : | 260.00 - 261.00 °C. @ 760.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| logp : | 3.38 |
| 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. ) : | 201.00 °F. TCC ( 93.89 °C. )
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| recommendation for rose absolute pentanol usage levels up to : |
| | 20.0000 % in the fragrance concentrate.
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| recommendation for rose absolute pentanol usage levels up to : |
| | not for flavor use.
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| safety links : | |
| (EINECS) number : | 259-461-3 |
| chemidplus : | 055066483 |
| epa-srs : | 55066-48-3 |
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| other : | |
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| references : | |
| pubchem : | 685667 |
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