| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | 3,7-dimethyloctane-1,7-diol |
| InChI : | InChI=1/C10H22O2/c1-9(6-8-11)5-4-7-10(2,3)12/h9,11-12H,4-8H2,1-3H3 |
| InChIKey : | FPCCDPXRNNVUOM-UHFFFAOYAY |
| SMILES : | CC(CCCC(C)(C)O)CCO |
| (EINECS) number : | 203-517-1 |
| cas number : | 107-74-4 |
| fema number : | 2586 |
| coe number : | 559 |
| jecfa number : | 610 |
| fl. number : | 02.047 |
| molar refractivity : | 51.37 ± 0.3 cm3 |
| parachor : | 455.9 ± 4.0 cm3 |
| index of refraction : | 1.455 ± 0.02 |
| surface tension : | 33.8 ± 3.0 dyne/cm |
| density : | 0.921 ± 0.06 g/cm3 |
| polarizability : | 20.36 ± 0.5 10-24cm3 |
| xlogp : | 2.20 |
| molecular weight : | 174.2804800 |
| formula : | C10 H22 O2 |
|
|
| |
| |
| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor type : | floral |
| odor strength : | low |
odor description :
at 100.00 %. | mild clean floral lily |
| substantivity : | 248 Hour(s) |
| properties : | |
| appearence : | colorless clear viscous liquid |
| assay : | 97.00 - 100.00 %
|
| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.92500 - 0.93300 @ 25.00 °C.
|
| pounds per gallon - calc. : | 7.697 to 7.763
|
| specific gravity : | 0.92600 - 0.93400 @ 20.00 °C.
|
| pounds per gallon - calc. : | 7.714 to 7.781
|
| refractive index : | 1.45700 - 1.46100 @ 20.00 °C.
|
| boiling point : | 124.00 - 125.00 °C. @ 1.00 mm Hg
|
| boiling point : | 156.00 °C. @ 15.00 mm Hg
|
| logp : | 2.54 |
| safety : | |
| Oral Toxicity(LD50) : |
Gavage-Rat [sex: M,F] >5000.00 mg/kg (Levenstein, 1973b)
|
| Dermal Toxicity(LD50) : |
Skin-Rabbit >5.00 gm/kg
|
| Maximised Survey-derived Daily Intakes (MSDI) : | 9.70 (μg/capita/day) |
| | |
| flash point ( Deg. F. ) : | > 212.00 °F. TCC ( > 100.00 °C. )
|
| | |
| recommendation for hydroxycitronellol usage levels up to : |
| | 20.0000 % in the fragrance concentrate.
|
| | |
| recommendation for hydroxycitronellol usage levels up to : |
| | 5.0000 ppm in the flavor.
|
| | |
| safety links : | |
| (EINECS) number : | 203-517-1 |
| chemidplus : | 000107744 |
| epa-srs : | 107-74-4 |
| dtp/nci : | 67886 |
| | |
| other : | |
| |
|
| references : | |
| jecfa number : | 610 |
| fl. number : | 02.047 |
| pubchem : | 150993 |
| NIST Chemistry WebBook : | 2694473933 |
| | |