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| CAS No.: | 121219-07-6 |
|---|---|
| Name: | 2,3-DIFLUOROETHOXYBENZENE |
| Molecular Structure: | |
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| Formula: | C8H8F2O |
| Molecular Weight: | 158.15 |
| Synonyms: | 1,2-Difluoro-3-ethoxybenzene;2,3-Difluoro-1-ethoxybenzene;2,3-Difluorophenyl ethyl ether;1-ethoxy-2,3-difluorobenzene;1-Ethoxy-2,3-difluorobenzene;1-Ethoxy-2,3-difluorbenzol;benzene, 1-ethoxy-2,3-difluoro-; |
| EINECS: | 441-000-4 |
| Density: | 1.143 g/cm3 |
| Boiling Point: | 167.6 °C at 760 mmHg |
| Flash Point: | 61.3 °C |
| Solubility: | 254mg/L at 20℃ |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | Xi:; ">  Xi:; |
| Safety: | 26-37 |
| PSA: | 9.23000 |
| LogP: | 2.36350 |
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Specification
The 2,3-Difluorophenetole, with the CAS registry number 121219-07-6, has the systematic name of 1-ethoxy-2,3-difluorobenzene. It belongs to the product categories of Aromatic Halides (substituted) and Anisole. And the molecular formula of this chemical is C8H8F2O. In addition, it should be stored in a cool place.
The physical properties of 2,3-Difluorophenetole are as following: (1)ACD/LogP: 2.68; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.68; (4)ACD/LogD (pH 7.4): 2.68; (5)ACD/BCF (pH 5.5): 63.92; (6)ACD/BCF (pH 7.4): 63.92; (7)ACD/KOC (pH 5.5): 682.44; (8)ACD/KOC (pH 7.4): 682.44; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.455; (14)Molar Refractivity: 37.55 cm3; (15)Molar Volume: 138.3 cm3; (16)Polarizability: 14.88×10-24cm3; (17)Surface Tension: 27.8 dyne/cm; (18)Density: 1.143 g/cm3; (19)Flash Point: 61.3 °C; (20)Enthalpy of Vaporization: 38.74 kJ/mol; (21)Boiling Point: 167.6 °C at 760 mmHg; (22)Vapour Pressure: 2.23 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cccc(OCC)c1F
(2)InChI: InChI=1/C8H8F2O/c1-2-11-7-5-3-4-6(9)8(7)10/h3-5H,2H2,1H3
(3)InChIKey: AVOGLGBKOFOSBN-UHFFFAOYAH