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| CAS No.: | 5197-62-6 |
|---|---|
| Name: | 2-[2-(2-CHLOROETHOXY)ETHOXY]ETHANOL |
| Article Data: | 12 |
| Molecular Structure: | |
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| Formula: | C6H13ClO3 |
| Molecular Weight: | 168.62 |
| Synonyms: | 2-[(2-Chloroethoxy)ethoxy]ethanol;2-[2-(2-Chloroethoxy)ethoxy]ethanol;8-Chloro-3,6-dioxa-1-octanol;8-Chloro-3,6-dioxaoctanol;Diethylene glycol mono(2-chloroethyl) ether;NSC2636;Triethylene glycol monochloride;Triethylene glycol monochlorohydrin; |
| EINECS: | 225-984-0 |
| Density: | 1.13 g/cm3 |
| Boiling Point: | 247.6 °C at 760 mmHg |
| Flash Point: | 107.2 °C |
| Appearance: | colourless liquid |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 38.69000 |
| LogP: | 0.25070 |
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Specification
The Ethanol,2-[2-(2-chloroethoxy)ethoxy]-, with CAS registry number 5197-62-6, belongs to the following product categories: (1)Ethylene Glycols & Monofunctional Ethylene Glycols; (2)Monofunctional Ethylene Glycols. It has the systematic name of 2-[2-(2-chloroethoxy)ethoxy]ethanol. This chemical is a kind of colourless liquid. And the chemical formula of this chemical is C6H13ClO3. What's more, its EINECS is 225-984-0.
Physical properties of Ethanol,2-[2-(2-chloroethoxy)ethoxy]-: (1)ACD/LogP: -0.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.52; (4)ACD/LogD (pH 7.4): -0.52; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 12.4; (8)ACD/KOC (pH 7.4): 12.4; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 27.69 Å2; (13)Index of Refraction: 1.445; (14)Molar Refractivity: 39.72 cm3; (15)Molar Volume: 149.1 cm3; (16)Polarizability: 15.74×10-24cm3; (17)Surface Tension: 35.9 dyne/cm; (18)Density: 1.13 g/cm3; (19)Flash Point: 107.2 °C; (20)Enthalpy of Vaporization: 56.33 kJ/mol; (21)Boiling Point: 247.6 °C at 760 mmHg; (22)Vapour Pressure: 0.00413 mmHg at 25°C.
Uses of Ethanol,2-[2-(2-chloroethoxy)ethoxy]-: it can be used to produce 2-[2-(2-iodoethoxy)ethoxy]ethanol. This reaction will need reagent NaI and solvent butan-2-one. The reaction time is 16 hour(s).
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When you are using this chemical, please be cautious about it as the following:
The Ethanol,2-[2-(2-chloroethoxy)ethoxy]- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: ClCCOCCOCCO
(2)InChI: InChI=1/C6H13ClO3/c7-1-3-9-5-6-10-4-2-8/h8H,1-6H2
(3)InChIKey: KECMLGZOQMJIBM-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C6H13ClO3/c7-1-3-9-5-6-10-4-2-8/h8H,1-6H2
(5)Std. InChIKey: KECMLGZOQMJIBM-UHFFFAOYSA-N