Ethyl 4,4,4-trifluoro-2-butynoate
Catalog No: FT-0677871
CAS No: 79424-03-6
- Chemical Name: Ethyl 4,4,4-trifluoro-2-butynoate
- Molecular Formula: C6H5F3O2
- Molecular Weight: 166.10
- InChI Key: SFDRHPQGYUYYNX-UHFFFAOYSA-N
- InChI: InChI=1S/C6H5F3O2/c1-2-11-5(10)3-4-6(7,8)9/h2H2,1H3
| 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 |
| Symbol: | Danger |
|---|---|
| FW: | 166.09800 |
| Density: | 1.162 g/mL at 25ºC(lit.) |
| CAS: | 79424-03-6 |
| Bolling_Point: | 96-98ºC(lit.) |
| Product_Name: | ethyl 4,4,4-trifluorobut-2-ynoate |
| Melting_Point: | N/A |
| Flash_Point: | 43 °F |
| MF: | C6H5F3O2 |
| Density: | 1.162 g/mL at 25ºC(lit.) |
|---|---|
| Computational_Chemistry: | ['1. XlogP :2 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :205 ', '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'] |
| Molecular_Structure: | ['五分子性质数据 ', '1 . Molar refractive index 3008 ', '2 . Molar volume （m3/mol）1307 ', '3 . Parachor （902K）2973 ', '4 . Surface tension 267 ', '5 . Dielectric constant N/A ', '6 偶极距（10 -24cm 3）N/A ', '7 . Polarizability 1192'] |
| LogP: | 1.11520 |
| Flash_Point: | 43 °F |
| Refractive_Index: | n20/D 1.350(lit.) |
| FW: | 166.09800 |
| PSA: | 26.30000 |
| MF: | C6H5F3O2 |
| Bolling_Point: | 96-98ºC(lit.) |
| Exact_Mass: | 166.02400 |
| Hazard_Codes: | F: Flammable;Xi: Irritant; |
|---|---|
| Symbol: | Danger |
| Packing_Group: | II |
| Hazard_Class: | 3.1 |
| Warning_Statement: | P210-P261-P305 + P351 + P338 |
| HS_Code: | 2916190090 |
| Personal_Protective_Equipment: | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Risk_Statements(EU): | R11 |
| Safety_Statements: | 16-26-36/37/39 |
| RIDADR: | UN 3272 3/PG 2 |
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