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Name	Ethyl 6,8-dichlorooctanoate	EINECS	435-080-1
CAS No.	1070-64-0	Density	1.094 g/cm³
PSA	26.30000	LogP	3.34620
Solubility	N/A	Melting Point	N/A
Formula	C₁₀H₁₈Cl₂O₂	Boiling Point	288.5 °C at 760 mmHg
Molecular Weight	241.158	Flash Point	105.1 °C
Transport Information	N/A	Appearance	Colorless to yellowish transparent liquid
Safety	26-36	Risk Codes	36/37/38
Molecular Structure		Hazard Symbols	Xi
Synonyms	6,8-Dichlorooctanoicacid ethyl ester;

Ethyl 6,8-dichlorooctanoate Synthetic route

: 1070-65-1
6-hydroxy-8-chlorooctanoic acid ethyl ester

: 1070-64-0
6,8-dichlorooctanoic acid ethyl ester

Conditions

Conditions	Yield
With phosgene; N,N'-dimethylbenzylamine In 1,2-dichloro-ethane at 10 - 75℃; for 2.5h; Concentration; Solvent; Reagent/catalyst; Temperature;	96.69%
With pyridine; thionyl chloride; benzene
With thionyl chloride In toluene at 100℃; for 5h; Reagent/catalyst; Solvent; Cooling with ice; Large scale;	480 kg

: C10H20O4

: 1070-64-0
6,8-dichlorooctanoic acid ethyl ester

Conditions

Conditions	Yield
With thionyl chloride at 80℃; for 4h; Reagent/catalyst; Temperature; Alkaline conditions;	87%

: 626-86-8
adipinic acid monoethyl ester

: 1070-64-0
6,8-dichlorooctanoic acid ethyl ester

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 1,1,2,2-tetrachloro-ethane; thionyl chloride / anschliessendes Behandeln mit Aethylen und Aluminiumchlorid und Behandeln der nach dem Versetzen mit wss.Salzsaeure erhaltenen nicht-waessrigen Phase des Reaktionsgemisches mit Natriumboranat in Aethanol 2: benzene; pyridine; thionyl chloride View Scheme

: 22054-13-3
7-hydroxyheptanal

: 1070-64-0
6,8-dichlorooctanoic acid ethyl ester

Conditions

Conditions	Yield
Multi-step reaction with 5 steps 1: Pt/γ-Al2O3 / toluene / 100 °C 2: alumina / 350 °C 3: Amberlyst-15 / 10 h / 100 °C 4: Pd/γ-Al2O3; hydrogen / water / 100 °C / 37503.8 Torr / Sealed tube 5: thionyl chloride / 4 h / 80 °C / Alkaline conditions View Scheme

: 6149-48-0
ethyl 7-hydroxyheptanoate

: 1070-64-0
6,8-dichlorooctanoic acid ethyl ester

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1: alumina / 350 °C 2: Amberlyst-15 / 10 h / 100 °C 3: Pd/γ-Al2O3; hydrogen / water / 100 °C / 37503.8 Torr / Sealed tube 4: thionyl chloride / 4 h / 80 °C / Alkaline conditions View Scheme

: 25118-23-4
ethyl 6-heptenoate

: 1070-64-0
6,8-dichlorooctanoic acid ethyl ester

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: Amberlyst-15 / 10 h / 100 °C 2: Pd/γ-Al2O3; hydrogen / water / 100 °C / 37503.8 Torr / Sealed tube 3: thionyl chloride / 4 h / 80 °C / Alkaline conditions View Scheme

: 1070-64-0
6,8-dichlorooctanoic acid ethyl ester

: 1200-22-2
(R)-1,2-dithiolane-3-pentanoic acid

Conditions

Conditions	Yield
With ammonium hydrogen sulfite; sodium sulfide nonahydrate; sulfur In propan-1-ol; water; isopropyl alcohol at 70℃; for 3.5h; Temperature; Solvent; Reagent/catalyst; Inert atmosphere; Darkness;	30.6%

: 1070-64-0
6,8-dichlorooctanoic acid ethyl ester

: 98997-92-3
6,8-dichloro-octan-1-ol

Conditions

Conditions	Yield
With lithium aluminium tetrahydride; diethyl ether

: 1070-64-0
6,8-dichlorooctanoic acid ethyl ester

: 100911-03-3
5,7-dichloro-heptanoic acid

: 1070-64-0
6,8-dichlorooctanoic acid ethyl ester

: 120089-31-8
8-bromo-1,3-dichloro-octane

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: lithium alanate; diethyl ether 2: tetrachloromethane; phosphorus (III)-bromide View Scheme

Ethyl 6,8-dichlorooctanoate Chemical Properties

Molecular Structure:

Molecular Formula: C₁₀H₁₈Cl₂O₂
Molecular Weight: 241.1547
IUPAC Name: Ethyl 6,8-dichlorooctanoate
Synonyms of Octanoic acid, 6,8-dichloro-, ethyl ester (CAS NO.1070-64-0): 4-02-00-00998 (Beilstein Handbook Reference) ; 6,8-Dichlorooctanoic acid ethyl ester ; BRN 1771820
CAS NO: 1070-64-0
Index of Refraction: 1.455
Molar Refractivity: 59.8 cm³
Molar Volume: 220.2 cm³
Surface Tension: 33.2 dyne/cm
Density: 1.094 g/cm³
Flash Point: 105.1 °C
Enthalpy of Vaporization: 52.78 kJ/mol
Boiling Point: 288.5 °C at 760 mmHg
Vapour Pressure: 0.00233 mmHg at 25°C

Ethyl 6,8-dichlorooctanoate Uses

Octanoic acid, 6,8-dichloro-, ethyl ester (CAS NO.1070-64-0) is used for vitamin class medicine lipoic acid, lipoic amide intermediates.

Ethyl 6,8-dichlorooctanoate Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mammal (species unspecified)	LD50	oral	3700mg/kg (3700mg/kg)	BEHAVIORAL: EXCITEMENT LUNGS, THORAX, OR RESPIRATION: DYSPNEA	Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 21(10), Pg. 39, 1977.

Ethyl 6,8-dichlorooctanoate Safety Profile

Hazard Codes of Octanoic acid, 6,8-dichloro-, ethyl ester (CAS NO.1070-64-0): Irritant Xi
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
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

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