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| IUPAC name : | (2Z)-3,7-dimethylocta-2,6-dien-1-ol |
| InChI : | InChI=1/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7- |
| InChIKey : | GLZPCOQZEFWAFX-YFHOEESVBO |
| SMILES : | CC(=CCC/C(=C\CO)/C)C |
| (EINECS) number : | 203-378-7 |
| cas number : | 106-25-2 |
| fema number : | 2770 |
| coe number : | 2018 |
| jecfa number : | 1224 |
| fl. number : | 02.058 |
| molar refractivity : | 49.71 ± 0.3 cm3 |
| parachor : | 413.5 ± 4.0 cm3 |
| index of refraction : | 1.470 ± 0.02 |
| surface tension : | 29.1 ± 3.0 dyne/cm |
| density : | 0.866 ± 0.06 g/cm3 |
| polarizability : | 19.70 ± 0.5 10-24cm3 |
| xlogp : | 2.50 |
| molecular weight : | 154.2493200 |
| formula : | C10 H18 O |
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| IUPAC name : | (2E)-3,7-dimethylocta-2,6-dien-1-ol |
| InChI : | InChI=1/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+ |
| InChIKey : | GLZPCOQZEFWAFX-JXMROGBWBZ |
| SMILES : | CC(=CCC/C(=C/CO)/C)C |
| (EINECS) number : | 203-377-1 |
| cas number : | 106-24-1 |
| fema number : | 2507 |
| coe number : | 60 |
| jecfa number : | 1223 |
| fl. number : | 02.012 |
| molar refractivity : | 49.71 ± 0.3 cm3 |
| parachor : | 413.5 ± 4.0 cm3 |
| index of refraction : | 1.470 ± 0.02 |
| surface tension : | 29.1 ± 3.0 dyne/cm |
| density : | 0.866 ± 0.06 g/cm3 |
| polarizability : | 19.70 ± 0.5 10-24cm3 |
| xlogp : | 2.50 |
| molecular weight : | 154.2493200 |
| formula : | C10 H18 O |
| BioActivity Analysis : | 74795 |
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| fda reg : | 172.515 |
h. number : | 2905.22.0000 |
| organoleptics : | |
| odor type : | floral |
| odor strength : | medium |
odor description :
at 100.00 %. | sweet natural neroli citrus magnolia |
| taste description³ : | at ppm.
lemon, biiter, green and fruity with a terpy nuance |
| substantivity : | 44 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 98.00 - 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | Yes |
| specific gravity : | 0.87500 - 0.88300 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.281 to 7.347
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| specific gravity : | 0.87600 - 0.88400 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.298 to 7.364
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| refractive index : | 1.47500 - 1.47600 @ 20.00 °C.
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| boiling point : | 103.00 - 105.00 °C. @ 9.00 mm Hg
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| boiling point : | 225.00 - 227.00 °C. @ 760.00 mm Hg
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| logp : | 3.47 |
| shelf life : | 24.00 month(s) or longer if stored properly. |
| storage : | store in cool, dry place in tightly sealed containers, protected from heat and light. |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
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| Oral Toxicity(LD50) : |
Oral-Rat 4500.00 mg/kg FCTXAV 14,623,1976
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| Dermal Toxicity(LD50) : |
Skin-Rabbit >5.00 gm/kg FCTXAV 14,623,1976
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| flash point ( Deg. F. ) : | 226.00 °F. TCC ( 107.78 °C. )
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| recommendation for nerol usage levels up to : |
| | 20.0000 % in the fragrance concentrate.
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| recommendation for nerol usage levels up to : |
| | 20.0000 ppm in the flavor.
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| safety links : | |
| msds : | msds |
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| (EINECS) number : | 203-378-7 |
| rtecs : | RG5840000 for 106-25-2 |
| chemidplus : | 000106252 |
| epa-srs : | 106-25-2 |
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| (EINECS) number : | 203-377-1 |
| rtecs : | RG5830000 for 106-24-1 |
| chemidplus : | 000106241 |
| epa-srs : | 106-24-1 |
| dtp/nci : | 9279 |
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| other : | |
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C of A
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| references : | |
| pubchem : | 150888 |
| NIST Chemistry WebBook : | 60546289 |
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| pubchem : | 150887 |
| NIST Chemistry WebBook : | 1583608075 |
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| reference : | Mosciano, Gerard P&F 20, No. 2, 37, (1995)³ |