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| CAS No.: | 84011-15-4 |
|---|---|
| Name: | 2,2-DIFLUOROETHYL TRIFLUOROMETHYL ETHER |
| Article Data: | 1 |
| Molecular Structure: | |
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| Formula: | C3H3F5O |
| Molecular Weight: | 150.048 |
| Synonyms: | 1,1-Difluoroethyltrifluoromethyl ether;1-Trifluoromethoxy-2,2-difluoroethane; |
| Density: | 1.338 g/cm3 |
| Boiling Point: | 0.4 °C at 760 mmHg |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37/39 |
| PSA: | 9.23000 |
| LogP: | 1.78790 |
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- Total:8 Page 1 of 1 1
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Specification
The Ethane,1,1-difluoro-2-(trifluoromethoxy)-, with the CAS registry number 84011-15-4, is also known as 2,2-Difluoroethyl trifluoromethyl ether. This chemical's molecular formula is C3H3F5O and molecular weight is 150.05. What's more, both its IUPAC name and systematic name are the same which is called 1,1-Difluoro-2-(trifluoromethoxy)ethane.
Physical properties about Ethane,1,1-difluoro-2-(trifluoromethoxy)- are: (1) ACD/LogP: 1.54; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 1.54; (4) ACD/LogD (pH 7.4): 1.54; (5) ACD/BCF (pH 5.5): 8.7; (6) ACD/BCF (pH 7.4): 8.7; (7) ACD/KOC (pH 5.5): 163.67; (8) ACD/KOC (pH 7.4): 163.67; (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: 1.261; (14) Molar Refractivity: 18.43 cm3; (15) Molar Volume: 112 cm3; (16) Surface Tension: 12.6 dyne/cm; (17) Density: 1.338 g/cm3; (18) Enthalpy of Vaporization: 23.94 kJ/mol; (19) Boiling Point: 0.4 °C at 760 mmHg; (20) Vapour Pressure: 1780 mmHg at 25 °C.
When you are dealing with this chemical, you should be very careful. This chemical is irritating to eyes, respiratory system and skin. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. And in case of contacting 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: FC(F)COC(F)(F)F
(2) InChI: InChI=1/C3H3F5O/c4-2(5)1-9-3(6,7)8/h2H,1H2
(3) InChIKey: SFNHUVOCGCQZEG-UHFFFAOYAM