| Identification | More | [Name]
Ethyl 6,8-dichlorooctanoate | [CAS]
1070-64-0 | [Synonyms]
6,8-DICHLOROETHYLCAPRYLATE
6,8-DICHLORO-OCTANOIC ACID ETHYL ESTER
ETHYL 6,8-DICHLORO CAPRYLATE
ETHYL-6,8-DICHLOROOCTANATE
ETHYL 6,8-DICHLOROOCTANOATE
6,8-dichloro-octanoicaciethylester
6,8-DICHLOROOCTANOATE
6,8-DICHLOROOCTANOIC ACID ETHYL ESTER(EDCO)
6,8-DICHLOROETHYLOCTANOATE
6,8-Dichlorethylcaprylat
6,8-Dichlorooctanoic acid ethyl ester
Ethyl-6,8-dichloroctanoate | [EINECS(EC#)]
435-081-0 | [Molecular Formula]
C10H18Cl2O2 | [MDL Number]
MFCD01711127 | [Molecular Weight]
241.15 | [MOL File]
1070-64-0.mol |
| Chemical Properties | Back Directory | [Boiling point ]
109 °C(Press: 0.7 Torr) | [density ]
1.107 g/mL at 25 °C(lit.)
| [refractive index ]
n20/D 1.462(lit.)
| [Fp ]
>230 °F
| [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
Chloroform, Ethyl Acetate (Slightly) | [form ]
Oil | [color ]
Colourless to Pale Yellow | [InChI]
InChI=1S/C10H18Cl2O2/c1-2-14-10(13)6-4-3-5-9(12)7-8-11/h9H,2-8H2,1H3 | [InChIKey]
RFYDWSNYTVVKBR-UHFFFAOYSA-N | [SMILES]
C(OCC)(=O)CCCCC(Cl)CCCl | [CAS DataBase Reference]
1070-64-0(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing . | [RIDADR ]
UN 3082 9 / PGIII | [WGK Germany ]
2
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| Hazard Information | Back Directory | [Chemical Properties]
Colourless to Pale Yellow Oil | [Uses]
6,8-Dichlorooctanoic Acid Ethyl Ester is an industrial toxin as well as an intermediate product of lipoic acid synthesis. | [Flammability and Explosibility]
Notclassified | [Synthesis]
Dichloroethane in the organic solvent, 6-hydroxy -Chloro - octanoic acid ethyl ester with chlorinated reagent solid phosgene inN, N-dimethyl benzyl amine for the acid-binding agentEthyl 6-hydroxy-8-chlorooctanoate,Chlorination reagents,N, N-dimethylbenzylamine molar ratio1: 1.05: 0.12,The organic solvent was reacted with 6-hydroxy-8-The weight ratio of ethyl chlorocaprylate was1: 2.4 at a temperature ofN, N-dimethylbenzylamine was added dropwise at 10℃,Insulation temperature of 75 ,Insulation time 150min,In the reaction solution obtained,Water layer, water and 6 - hydroxy -8-chloro-ethyl octanoate weight ratio of 1:3, the upper organic phase.Vacuum distillation to collect vacuum 5mmHg,A temperature of 172-176℃,Ethyl 6,8-dichlorooctanoate,Product mol yield 95.68%, Purity 96.65%The bottom of the liquid base to adjust the pH value of 11,Layered,The upper layer was dewatered with sodium sulfateN, N-dimethylbenzylamine,The molar yield of the product was 96.69%Purity 99.71%.
 | [References]
[1] Patent: CN105693510, 2016, A. Location in patent: Paragraph 0047; 0048; 0049
[2] Journal of the American Chemical Society, 1955, vol. 77, p. 416,418
[3] Patent: CN106966900, 2017, A. Location in patent: Paragraph 0014; 0015; 0016; 0017; 0018; 0019; 0020; 0021 |
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