| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | 2-methyl-4-phenylpentan-1-ol |
| InChI : | InChI=1/C12H18O/c1-10(9-13)8-11(2)12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3 |
| InChIKey : | SXGYZCMGVZKIPJ-UHFFFAOYAP |
| SMILES : | CC(CC(C)C1=CC=CC=C1)CO |
| (EINECS) number : | 402-770-7 |
| cas number : | 92585-24-5 |
| molar refractivity : | 55.82 ± 0.3 cm3 |
| parachor : | 455.7 ± 4.0 cm3 |
| index of refraction : | 1.509 ± 0.02 |
| surface tension : | 35.3 ± 3.0 dyne/cm |
| density : | 0.953 ± 0.06 g/cm3 |
| polarizability : | 22.13 ± 0.5 10-24cm3 |
| xlogp : | 3.10 |
| molecular weight : | 178.2707200 |
| formula : | C12 H18 O |
|
|
| |
| |
| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor type : | citrus |
| odor strength : | medium |
odor description :
at 100.00 %. | citrus grapefruit floral green vetiver |
| substantivity : | 348 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 97.00 - 100.00 %
|
| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.95800 - 0.96600 @ 25.00 °C.
|
| pounds per gallon - calc. : | 7.972 to 8.038
|
| refractive index : | 1.51000 - 1.51400 @ 20.00 °C.
|
| boiling point : | 274.00 - 275.00 °C. @ 760.00 mm Hg
|
| logp : | 3.25 |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
| | |
| Oral Toxicity(LD50) : |
Oral-Rat >3000.00 mg/kg
|
| Dermal Toxicity(LD50) : |
Skin-Rabbit 3000.00 mg/kg
|
| | |
| flash point ( Deg. F. ) : | 219.00 °F. TCC ( 103.89 °C. )
|
| | |
| recommendation for grapefruit pentanol usage levels up to : |
| | 2.0000 % in the fragrance concentrate.
|
| | |
| recommendation for grapefruit pentanol usage levels up to : |
| | not for flavor use.
|
| | |
| safety links : | |
| (EINECS) number : | 402-770-7 |
| chemidplus : | 092585245 |
| epa-srs : | 92585-24-5 |
| | |
| other : | |
| |
|
| references : | |
| pubchem : | 3790448 |
| | |