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| CAS No.: | 61166-00-5 |
|---|---|
| Name: | 3,3'-Ethylenedioxydiphenol |
| Molecular Structure: | |
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| Formula: | C14H14O4 |
| Molecular Weight: | 246.263 |
| Synonyms: | Phenol,3,3'-(ethylenedioxy)di- (6CI,7CI);1,2-Bis(3-hydroxyphenoxy)ethane;3,3'-Ethylenedioxydiphenol;3,3'-[Ethane-1,2-diylbis(oxy)]diphenol;3,3'-(1,2-Ethanediylbis(oxy))bisphenol; |
| EINECS: | 262-630-4 |
| Density: | 1.261 g/cm3 |
| Melting Point: | 157-160 °C(lit.) |
| Boiling Point: | 466.6 °C at 760 mmHg |
| Flash Point: | 236 °C |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26 |
| PSA: | 58.92000 |
| LogP: | 2.55560 |
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Specification
The Phenol,3,3'-[1,2-ethanediylbis(oxy)]bis-, with the CAS registry number 61166-00-5, is also known as 1,2-Bis(3-hydroxyphenoxy)ethane. Its EINECS number is 262-630-4 and its systematic name is 3,3'-[Ethane-1,2-diylbis(oxy)]diphenol. This chemical's molecular formula is C14H14O4 and molecular weight is 246.26. What's more, it belongs to the product categories of Fluorenes, etc. (reagent for high-performance polymer research); Functional Materials; Reagent for High-Performance Polymer Research; Alcohols; Monomers; Polymer Science. The product should be sealed and stored in containers which are placed in cool and dry places. It should be protected from water.
Physical properties of Phenol,3,3'-[1,2-ethanediylbis(oxy)]bis- are: (1)ACD/LogP: 2.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.57; (4)ACD/LogD (pH 7.4): 2.57; (5)ACD/BCF (pH 5.5): 53.16; (6)ACD/BCF (pH 7.4): 52.38; (7)ACD/KOC (pH 5.5): 598.05; (8)ACD/KOC (pH 7.4): 589.34; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 36.92 Å2; (13)Index of Refraction: 1.608; (14)Molar Refractivity: 67.57 cm3; (15)Molar Volume: 195.1 cm3; (16)Polarizability: 26.78×10-24 cm3; (17)Surface Tension: 52.6 dyne/cm; (18)Density: 1.261 g/cm3; (19)Flash Point: 236 °C; (20)Enthalpy of Vaporization: 75.63 kJ/mol; (21)Boiling Point: 466.6 °C at 760 mmHg; (22)Vapour Pressure: 2.5E-09 mmHg at 25°C.
Uses of Phenol,3,3'-[1,2-ethanediylbis(oxy)]bis-: it can be used to produce C20H18O4 by heating. It will need reagent K2CO3 and solvent acetone with the reaction time of 5 days. The yield is about 70%.
![Phenol,3,3'-[1,2-ethanediylbis(oxy)]bis- can be used to produce C20H18O4 by heating](/UserFilesUpload/Uses of Phenol,3,3'-[1,2-ethanediylbis(oxy)]bis-.png)
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1cccc(O)c1)CCOc2cccc(O)c2
(2)InChI: InChI=1/C14H14O4/c15-11-3-1-5-13(9-11)17-7-8-18-14-6-2-4-12(16)10-14/h1-6,9-10,15-16H,7-8H2
(3)InChIKey: DBFHCPVZZSVFJL-UHFFFAOYSA-N