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| CAS No.: | 1113-21-9 |
|---|---|
| Name: | Geranyl linalool |
| Molecular Structure: | |
|
|
|
| Formula: | C20H34O |
| Molecular Weight: | 290.489 |
| Synonyms: | 1,6,10,14-Hexadecatetraen-3-ol,3,7,11,15-tetramethyl-, (E,E)- (8CI);(E,E)-Geranyllinalool;Geranyllinalool;Linalool, geranyl-; |
| EINECS: | 214-201-8 |
| Density: | 0.876 g/cm3 |
| Melting Point: | 51oC |
| Boiling Point: | 389.9 °C at 760 mmHg |
| Flash Point: | 124.4 °C |
| Solubility: | insoluble in water |
| Appearance: | clear colourless to pale yellowish liquid |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 20.23000 |
| LogP: | 6.12280 |
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Chemistry
IUPAC Name: (3R,6E,10E)-3,7,11,15-Tetramethylhexadeca-1,6,10,14-tetraen-3-ol
CAS: 1113-21-9
Formula : C20H34O
Molecular Weight: 290.48
Molecular Structure of (3R,6E,10E)-3,7,11,15-Tetramethylhexadeca-1,6,10,14-tetraen-3-ol ( 1113-21-9):
Density: 0.876 g/cm3
Flash Point: 124.4 °C
Boiling Point: 389.9 °C at 760 mmHg
Appearance: clear colourless to pale yellowish liquid
Index of Refraction: 1.488
Boiling Point: 250 °C
Molar Refractivity: 95.63 cm3
Molar Volume: 331.5 cm3
Polarizability: 37.91×10-24cm3
Surface Tension: 30.4 dyne/cm
Enthalpy of Vaporization: 73.92 kJ/mol
Vapour Pressure: 1.09E-07 mmHg at 25°C
Water Solubility: 0.006982(mg/L) at 25°C
Product Categories: biochemistry;terpenes;terpenes.
Toxicity Data With Reference
| 1. | skn-rbt 500 mg | FCTOD7 Food and Chemical Toxicology. 30 (1992),41S. | ||
| 2. | eye-rbt 100 mg | FCTOD7 Food and Chemical Toxicology. 30 (1992),41S. | ||
| 3. | orl-rat LD50:>5 g/kg | FCTOD7 Food and Chemical Toxicology. 30 (1992),41S. | ||
| 4. | ipr-mus LD50:>2 g/kg | FCTOD7 Food and Chemical Toxicology. 30 (1992),41S. | ||
| 5. | skn-rbt LD50:>5 g/kg | FCTOD7 Food and Chemical Toxicology. 30 (1992),41S. |
Consensus Reports
Reported in EPA TSCA Inventory.
Safety Profile
Low toxicity by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and irritating vapors.
Safety Information about 3R,6E,10E)-3,7,11,15-Tetramethylhexadeca-1,6,10,14-tetraen-3-ol ( 1113-21-9):
Hazard Codes:
Xi: 
Risk Statements about 3R,6E,10E)-3,7,11,15-Tetramethylhexadeca-1,6,10,14-tetraen-3-ol ( 1113-21-9):
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements about 3R,6E,10E)-3,7,11,15-Tetramethylhexadeca-1,6,10,14-tetraen-3-ol ( 1113-21-9):
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36: Wear suitable protective clothing.
F10: Keep under argon.
WGK Germany: 2
RTECS: MM0335000
Specification
The chemical synonyms of (3R,6E,10E)-3,7,11,15-Tetramethylhexadeca-1,6,10,14-tetraen-3-ol ( 1113-21-9) are (e,e)-3,7,11,15-Tetramethylhexadeca-1,6,10,14 ; (e,e)-3,7,11,15-Tetramethylhexadeca-1,6,10,14-tetraen-3-ol ; 10,14-Hexadecatetraen-3-ol,3,7,11,15-tetramethyl-,(e,e)-6 ; 6,10,14-Hexadecatetraen-3-ol,3,7,11,15-tetramethyl-,(E,E)-1 ; e,e-3,7,11,15-Tetramethyl-1,6,10,14-hexadecatetraen-3-ol ; Geranyllinalool,mixtureofisomers ; 7,11,15-Tetramethyl-1,6,10,14-hexadecatetraen-3-ol ; 3,7,11,15-Tetramethyl-1,6,10,14-hexadecatetraene-3-ol .If contact with skin or eyes,immediately flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids.Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.Do NOT induce vomiting.If conscious and alert,rinse mouth and drink 2-4 cupfuls of milk or water.Remove from exposure and move to fresh air immediately. Wash thoroughly after handling. Remove contaminated clothing and wash before reuse.Avoid contact with eyes, skin,and clothing.Avoid ingestion and inhalation.Store in a cool,dry place.Keep container closed when not in use.