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CAS No.: 111-96-6
Name: Diethylene Glycol Dimethyl Ether
Molecular Structure:
Molecular Structure of 111-96-6 (Diethylene Glycol Dimethyl Ether)
Formula: C6H14O3
Molecular Weight: 134.175
Synonyms: Ether,bis(2-methoxyethyl) (6CI,8CI);(2-Methoxyethyl) ether;1,1'-Oxybis[2-methoxyethane];1,5-Dimethoxy-3-oxapentane;1-(2-Methoxyethoxy)-2-methoxyethane;2,5,8-Trioxanonane;2-(2-Methoxyethoxy)-1-methoxyethane;Ansul Ether 141;Bis(2-methoxyethyl) ether;Ethane,1,1'-oxybis[2-methoxy-;Di(2-methoxyethyl) ether;Diethylene glycoldimethyl ether;Dimethyl carbitol;Dimethyl digol;Ethanol, 2,2'-oxybis-,dimethyl ether;Glyme 2;Glyme 3;Hisolve MDM;Methyl diglyme;Poly-Solv;Diglyme;
EINECS: 203-924-4
Density: 0.914 g/cm3
Melting Point: -64 ºC
Boiling Point: 159.8 ºC at 760 mmHg
Flash Point: 70 ºC
Solubility: Miscible
Appearance: clear liquid
Hazard Symbols: ToxicT
Risk Codes: 60-61-10-19
Safety: 53-45
Transport Information: UN 3271 3/PG 3
PSA: 27.69000
LogP: 0.29580
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Specification

The 2-Methoxyethyl ether, with its CAS NO.111-96-6, is a clear, colorless liquid with a slight ether-like odor. It is miscible with water, alcohols, diethyl ether, and hydrocarbon solvents. Its Synonyms are Diethylene glycol dimethyl ether; Dimethoxydiglycol; (2-Methoxyethyl) ether; 1,1'-Oxybis(2-methoxyethane); 2,5,8-Trioxanonane; 2-(2-Methoxyethoxy)-1-methoxyethane and Bis(2-methoxyethyl) ether. 2-Methoxyethyl ether should be stored in shady and cool warehouse and mainly used as the solvent, also used as non-pollution cleansing agents, extraction solvent, diluent, etc.

Physical properties about 2-Methoxyethyl ether are: (1)ACD/LogP: -0.798; (2)ACD/LogD (pH 5.5): -0.80; (3)ACD/LogD (pH 7.4): -0.80; (4)ACD/BCF (pH 5.5): 1.00; (5)ACD/BCF (pH 7.4): 1.00; (6)ACD/KOC (pH 5.5): 8.77; (7)ACD/KOC (pH 7.4): 8.77; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 6; (10)Index of Refraction: 1.393; (11)Molar Refractivity: 35.082 cm3; (12)Molar Volume: 146.663 cm3; (13)Polarizability: 13.907 10-24cm3; (14)Surface Tension: 25.5890007019043 dyne/cm; (15)Density: 0.915 g/cm3; (16)Flash Point: 70 °C; (17)Enthalpy of Vaporization: 38.007 kJ/mol; (18)Boiling Point: 159.759 °C at 760 mmHg; (19)Vapour Pressure: 3.20099997520447 mmHg at 25°C

When you are using this chemical, please be cautious about it as the following:
1. Avoid exposure - obtain special instruction before use;
2. In case of accident or if you feel unwell, seek medical advice immediately (show label where possible);

You can still convert the following datas into molecular structure:
(1)InChI=1S/C6H14O3/c1-7-3-5-9-6-4-8-2/h3-6H2,1-2H3;
(2)InChIKey=SBZXBUIDTXKZTM-UHFFFAOYSA-N;
(3)SmilesO(CCOC)CCOC;

 The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 6gm/kg (6000mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION
Toksikologicheskii Vestnik. Vol. (1), Pg. 27, 1996.
rat LD50 oral 5400mg/kg (5400mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION
Toksikologicheskii Vestnik. Vol. (1), Pg. 27, 1996.