

3-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]PROP-2-YN-1-OL
Catalog No: FT-0614826
CAS No: 81613-61-8
- Molecular Formula: 268.15
- Formula Weight: C11H6F6O
- Inchl Key: UWJBHKXJMSHKKD-UHFFFAOYSA-N
- Inchl: InChI=1S/C11H6F6O/c12-10(13,14)8-4-7(2-1-3-18)5-9(6-8)11(15,16)17/h4-6,18H,3H2
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Product_Name: | 3-[3,5-Bis(trifluoromethyl)phenyl]-2-propyn-1-ol |
---|---|
Flash_Point: | 99.4±27.3 °C |
Melting_Point: | 58 °C |
FW: | 268.155 |
Density: | 1.5±0.1 g/cm3 |
CAS: | 81613-61-8 |
Bolling_Point: | 240.8±40.0 °C at 760 mmHg |
MF: | C11H6F6O |
LogP: | 3.75 |
---|---|
Flash_Point: | 99.4±27.3 °C |
Refractive_Index: | 1.458 |
FW: | 268.155 |
Density: | 1.5±0.1 g/cm3 |
Bolling_Point: | 240.8±40.0 °C at 760 mmHg |
Computational_Chemistry: | ['1. XlogP :32 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :7 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :18 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :322 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
Melting_Point: | 58 °C |
PSA: | 20.23000 |
MF: | C11H6F6O |
More_Info: | ['1 . Appearance Unknow ', '2 . Density(g/mL25 ºC)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)58 ', '5 . Boiling point(ºC,Atmospheric pressure)84 ', '6 . Boiling point(ºC2mmHg)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(℉)Unknow ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,)Unknow ', '12 . Saturated vapor pressure(kPa,60ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(KPa)Unknow ', '16 . Oil-water(正Octanol /Water )Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility Unknow'] |
Vapor_Pressure: | 0.0±0.5 mmHg at 25°C |
Exact_Mass: | 268.032288 |
Hazard_Codes: | Xi |
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Risk_Statements(EU): | R36/37/38 |
HS_Code: | 2906299090 |
Safety_Statements: | S26-S36/37/39 |
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