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78-69-3

Basic Information
CAS No.: 78-69-3
Name: 3-Octanol,3,7-dimethyl-
Article Data: 40
Cas Database
Molecular Structure:
Molecular Structure of 78-69-3 (3-Octanol,3,7-dimethyl-)
Formula: C10H22O
Molecular Weight: 158.284
Synonyms: 2,6-Dimethyl-6-octanol;3,7-Dimethyloctan-3-ol;Linalool tetrahydride;NSC 128151;
EINECS: 201-133-9
Density: 0.828 g/cm3
Melting Point: -1.53°C (estimate)
Boiling Point: 194.5 °C at 760 mmHg
Flash Point: 76.1 °C
Solubility: N/A
Appearance: Clear colorless liquid
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38-36/38
Safety: 26-36-37/39
Transport Information: N/A
PSA: 20.23000
LogP: 2.97370
Synthetic route

2,6-dimethyl-6-(triphenylsilyloxy)octane

78-69-3

tetrahydrolinalool

Conditions
ConditionsYield
With naphthalene; lithium In tetrahydrofuran; methanol at 20℃; for 5h;98%
144708-84-9

6-Methoxymethoxy-2,6-dimethyl-octane

78-69-3

tetrahydrolinalool

Conditions
ConditionsYield
With methanol; DOWEX-50W-X2 for 2h; Heating;94%
78-70-6

3,7-dimethylocta-1,6-dien-3-ol

78-69-3

tetrahydrolinalool

Conditions
ConditionsYield
With ammonium chloride In methanol Electrochemical reaction;93%
With (bis-1,2-diphenylphosphinoethane)Co(CH2SiMe3)2; hydrogen In toluene at -196.15 - 25℃; under 3040.2 Torr; for 14h; Reagent/catalyst; Sealed tube;82%
With hydrogen at 80℃; under 7500.75 Torr; for 1h; Autoclave;68%
78-70-6

3,7-dimethylocta-1,6-dien-3-ol

A

78-69-3

tetrahydrolinalool

B

18479-51-1

dihydrolinalool

Conditions
ConditionsYield
With iron(III) chloride hexahydrate; hydrazine hydrate In ethanol at 80℃; for 36h;A 82%
B 18%
With air; hydrazine hydrate In ethanol at 25℃; for 4h;
126-91-0

linalool

78-69-3

tetrahydrolinalool

Conditions
ConditionsYield
With hydrogen; platinum levorotatory substances of 2,6-dimethyl-octanol-(6);
With ethanol; water; hydrogen in Gegenwart von Katalysatoren der Platingruppe; levorotatory substances of 2,6-dimethyl-octanol-(6);
78-70-6

3,7-dimethylocta-1,6-dien-3-ol

A

2051-30-1

2,6-dimethyloctane

B

78-69-3

tetrahydrolinalool

Conditions
ConditionsYield
With hydrogen; nickel at 130 - 140℃; Hydrogenation;
With hydrogen; nickel
123-92-2

3-methyl-1-butyl acetate

925-90-6

ethylmagnesium bromide

78-69-3

tetrahydrolinalool

Conditions
ConditionsYield
inactive form of 2,6-dimethyl-octanol-(6);
18479-51-1

dihydrolinalool

A

2051-30-1

2,6-dimethyloctane

B

78-69-3

tetrahydrolinalool

Conditions
ConditionsYield
With hydrogen; nickel at 130 - 140℃; Hydrogenation;
With hydrogen; nickel
18479-51-1

dihydrolinalool

78-69-3

tetrahydrolinalool

Conditions
ConditionsYield
With nickel pumice stone at 100℃; under 15 Torr; Hydrogenation;
1604-26-8

hydrodehydrolinalool

78-69-3

tetrahydrolinalool

Conditions
ConditionsYield
With platinum Hydrogenation;
With nickel Hydrogenation;
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    Name: Tetrahydrolinalool. The English synonym: TETRAHYDROLINALOOL; (±)-3 meme 7 LIMETHYLOLTANLLLYLLINOLYLLINOLYLLINOLINOLYLINOLINOLYLINOLYLINOLYLINOLYLYLINOLYLINOLYLINOLYLTANLYLYLINOLYLYLINOLYLTANOLINOLYLYLTANOLINOLYLYLTANOLYL tetrahydride.

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  • 3-Methyl-2-hexanone

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Chemistry

Product Name: Tetrahydrolinalool
The MF of Tetrahydrolinalool(78-69-3) is C10H22O.

                         
The MW of Tetrahydrolinalool(78-69-3) is 158.28.
Synonyms: TETRAHYDROLINALOOL;3-OCTANOL, 3,7-DIMETHYL;3,7-DIMETHYL-3-OCTANOL;FEMA 3060;(±)-3,7-dimethyl-octan-3-ol;3,7-dimethyl-3-octano;3,7-Dimethyloctan-3-ol;2,6-Dimethyl-6-octanol
Product Categories: Alphabetical Listings;Flavors and Fragrances;Q-Z
Mol File: 78-69-3.mol
EINECS: 201-133-9
Surface Tension: 27.6 dyne/cm 
Density: 0.826 g/ml 
Flash Point: 76.1 °C 
Enthalpy of Vaporization: 50.12 kJ/mol 
Boiling Point: 194.5 °C at 760 mmHg 
Vapour Pressure: 0.115 mmHg at 25°C 
CAS DataBase Reference: 78-69-3(CAS DataBase Reference)
NIST Chemistry Reference: 78-69-3(NIST)
EPA Substance Registry System: 78-69-3(EPA Substance)

Uses

Tetrahydrolinalool(78-69-3) is mainly used for the preparation of spices and berries such as flavor.

Toxicity Data With Reference

OrganismTest TypeRouteReported Dose (Normalized Dose)EffectSource
mouseLD50oral4500mg/kg (4500mg/kg) Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 55(6), Pg. 86, 1990.
rabbitLD50skin> 5gm/kg (5000mg/kg) Food and Cosmetics Toxicology. Vol. 17, Pg. 909, 1979.
ratLD50oral> 5gm/kg (5000mg/kg) Food and Cosmetics Toxicology. Vol. 17, Pg. 909, 1979.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Low toxicity by ingestion. A skin irritant. When heated to decomposition it emits acrid smoke and irritating vapors.
Safety information of Tetrahydrolinalool(78-69-3):
Hazard Codes: Xi
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin 
Safety Statements: 26-36-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
S36: Wear suitable protective clothing
S37/39: Wear suitable gloves and eye/face protection
WGK Germany: 1
RTECS: RH0905000