4-TERT-BUTYLPHENOXYACETIC ACID
Catalog No: FT-0633849
CAS No: 1798-04-5
- Chemical Name: 4-TERT-BUTYLPHENOXYACETIC ACID
- Molecular Formula: C12H16O3
- Molecular Weight: 208.25
- InChI Key: FBIGAJNVRFKBJL-UHFFFAOYSA-N
- InChI: InChI=1S/C12H16O3/c1-12(2,3)9-4-6-10(7-5-9)15-8-11(13)14/h4-7H,8H2,1-3H3,(H,13,14)
| 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: | 96 °C(lit.) |
|---|---|
| CAS: | 1798-04-5 |
| MF: | C12H16O3 |
| Flash_Point: | 120.8ºC |
| Product_Name: | 4-tert-Butylphenoxyacetic acid |
| Density: | 1.088g/cm3 |
| FW: | 208.25400 |
| Bolling_Point: | 325.4ºC at 760mmHg |
| Refractive_Index: | 1.513 |
|---|---|
| Vapor_Pressure: | 9.43E-05mmHg at 25°C |
| Flash_Point: | 120.8ºC |
| LogP: | 2.44750 |
| Bolling_Point: | 325.4ºC at 760mmHg |
| Water_Solubility: | Very slightly soluble (0.56 g/L) (25 ºC) |
| FW: | 208.25400 |
| PSA: | 46.53000 |
| Computational_Chemistry: | ['1 . XlogP 32 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 3 ', '4 . Rotatable Bond Count 4 ', '5 . Isotope Atom Count ', '6 . TPSA 465 ', '7 . Heavy Atom Count 15 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 209 ', '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: | 96 °C(lit.) |
| MF: | C12H16O3 |
| Exact_Mass: | 208.11000 |
| Density: | 1.088g/cm3 |
| Safety_Statements: | S26-S36/37/39 |
|---|---|
| Hazard_Codes: | Xi |
| HS_Code: | 2918990090 |
| Risk_Statements(EU): | R36/37/38 |
