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Geranyl linalool

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Geranyl linalool

EINECS 214-201-8
CAS No. 1113-21-9 Density 0.876 g/cm3
PSA 20.23000 LogP 6.12280
Solubility insoluble in water Melting Point 51oC
Formula C20H34O Boiling Point 389.9 °C at 760 mmHg
Molecular Weight 290.489 Flash Point 124.4 °C
Transport Information N/A Appearance clear colourless to pale yellowish liquid
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 1113-21-9 (Geranyl linalool) Hazard Symbols IrritantXi
Synonyms

1,6,10,14-Hexadecatetraen-3-ol,3,7,11,15-tetramethyl-, (E,E)- (8CI);(E,E)-Geranyllinalool;Geranyllinalool;Linalool, geranyl-;

Article Data 11

Geranyl linalool Chemical Properties

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/cm
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.

Geranyl linalool 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.

Geranyl linalool Consensus Reports

Reported in EPA TSCA Inventory.

Geranyl linalool 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

Geranyl linalool 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. 

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