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| CAS No.: | 105-90-8 |
|---|---|
| Name: | 2,6-Octadien-1-ol,3,7-dimethyl-, 1-propanoate, (2E)- |
| Molecular Structure: | |
|
|
|
| Formula: | C13H22O2 |
| Molecular Weight: | 210.316 |
| Synonyms: | 2,6-Octadien-1-ol,3,7-dimethyl-, propanoate, (2E)- (9CI);2,6-Octadien-1-ol, 3,7-dimethyl-,propanoate, (E)-;2,6-Octadien-1-ol, 3,7-dimethyl-, propionate, (E)- (8CI);Propionic acid, geranyl ester (6CI);(E)-3,7-Dimethyl-2,6-octadien-1-olpropanoate;Geraniol propanoate;Geraniol propionate;Geranyl propanoate;trans-3,7-Dimethyl-2,6-octadienyl propionate; |
| EINECS: | 203-344-1 |
| Density: | 0.901 g/cm3 |
| Boiling Point: | 282.425 °C at 760 mmHg |
| Flash Point: | 97.655 °C |
| Solubility: | 2.22mg/L at 25℃ |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 26.30000 |
| LogP: | 3.63230 |
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Chemistry
IUPAC Name: 3,7-Dimethylocta-2,6-dienyl propanoate
CAS: 105-90-8
Formula : C13H22O2
Molecular Weight: 210.31
Molecular Structure of 3,7-Dimethylocta-2,6-dienyl propanoate (105-90-8):
Density: 0.9 g/cm3
Flash Point: 97.7 °C
Boiling Point: 282.4 °C at 760 mmHg
Index of Refraction: 1.459
Molar Refractivity: 63.85 cm3
Molar Volume: 233.4 cm3
Polarizability: 25.31×10-24cm3
Surface Tension: 28.8 dyne/cm
Enthalpy of Vaporization: 52.13 kJ/mol
Vapour Pressure: 0.00336 mmHg at 25°C
Water Solubility: 2.22(mg/L) at 25°C
Product Categories: certified natural productsflavors and fragrances;alphabetical listings;flavors and fragrances;G-H.
Toxicity Data With Reference
| 1. | orl-rat LD50:>5 g/kg | FCTXAV Food and Cosmetics Toxicology. 12 (1974),897. | ||
| 2. | skn-rbt LD50:>5 g/kg | FCTXAV Food and Cosmetics Toxicology. 12 (1974),897. |
Consensus Reports
Reported in EPA TSCA Inventory.
Safety Profile
Low toxicity by ingestion and skin contact. Combustible liquid. When heated to decomposition it emits acrid smoke and irritating fumes.
Safety Information about 3,7-Dimethylocta-2,6-dienyl propanoate (105-90-8):
Hazard Codes:
Xi: 
Risk Statements about 3,7-Dimethylocta-2,6-dienyl propanoate (105-90-8):
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements about 3,7-Dimethylocta-2,6-dienyl propanoate (105-90-8):
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36: Wear suitable protective clothing.
WGK Germany; 2
RTECS: RG5927906
Specification
The chemical synonyms of 3,7-Dimethylocta-2,6-dienyl propanoate (105-90-8) are 3,7-Dimethyl-2,6-octadien-1-yl n-propionate ; 2,6-Dimethyl octadien-6-yl-8-n-propionate ; Geranyl propionate ; Fema 2517 ; (2Z)-3,7-Dimethyl-2,6-octadienyl propionate ; (e)-3,7-Dimethyl-2,6-octadien-1-olpropionate ; 2,6-Octadien-1-o1, 3,7-dimethyl-, propanoate, (E)- .