1,1,1-TRIFLUORO-2-PHENYL-3-BUTYN-2-OL
Catalog No: FT-0642405
CAS No: 99727-20-5
- Chemical Name: 1,1,1-TRIFLUORO-2-PHENYL-3-BUTYN-2-OL
- Molecular Formula: C10H7F3O
- Molecular Weight: 200.16
- InChI Key: WWIJKFJKIOQDKI-UHFFFAOYSA-N
- InChI: InChI=1S/C10H7F3O/c1-2-9(14,10(11,12)13)8-6-4-3-5-7-8/h1,3-7,14H
| Assay | Pack Size | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Melting_Point: | N/A |
|---|---|
| CAS: | 99727-20-5 |
| MF: | C10H7F3O |
| Flash_Point: | 199 °F |
| Product_Name: | 1,1,1-trifluoro-2-phenyl-3-butyn-2-ol |
| Density: | 1.301 g/mL at 25 °C(lit.) |
| FW: | 200.15700 |
| Bolling_Point: | 202.1 °C(lit.) |
| Refractive_Index: | n20/D 1.473(lit.) |
|---|---|
| Flash_Point: | 199 °F |
| LogP: | 2.06970 |
| Bolling_Point: | 202.1 °C(lit.) |
| FW: | 200.15700 |
| PSA: | 20.23000 |
| Computational_Chemistry: | ['1. XlogP :23 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :244 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| MF: | C10H7F3O |
| Exact_Mass: | 200.04500 |
| Molecular_Structure: | ['1 . Molar refractive index 4445 ', '2 . Molar volume (m3/mol)1537 ', '3 . Parachor (902K)3746 ', '4 . Surface tension 352 ', '5 . Polarizability 1762'] |
| Density: | 1.301 g/mL at 25 °C(lit.) |
| More_Info: | ['1 . Appearance 无可用 ', '2 . Density(g/mL,25/4℃)1301 ', '3 . Relative vapor density(g/mL,Atmosphere =1)无可用 ', '4 . Melting point(ºC)无可用 ', '5 . Boiling point(ºC,Atmospheric pressure)2021 ', '6 . Boiling point(ºC,52kPa)无可用 ', '7 . Refractive index1473 ', '8 . Flash point(ºC)无可用 ', '9 . Specific rotation(º)无可用 ', '10 . Spontaneous ignition point or ignition temperature(ºC)无可用 ', '11 . Vapor pressure(kPa,25ºC)无可用 ', '12 . Saturated vapor pressure(kPa,60ºC)无可用 ', '13 . Combustion heat(KJ/mol)无可用 ', '14 . Critical temperature(ºC)无可用 ', '15 . Critical pressure(KPa)无可用 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion(%,V/V)无可用 ', '18 . Lower limit of explosion(%,V/V)无可用 ', '19 . Solubility 无可用'] |
| Safety_Statements: | S37/39-S26 |
|---|---|
| Hazard_Codes: | Xi: Irritant; |
| HS_Code: | 2906299090 |
| Risk_Statements(EU): | R36/37/38 |
| WGK_Germany: | 3 |
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