4-(Ethoxycarbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid
Catalog No: FT-0651494
CAS No: 5442-91-1
- Chemical Name: 4-(Ethoxycarbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid
- Molecular Formula: C10H13NO4
- Molecular Weight: 211.21
- InChI Key: DXKYHAPIBYYLJR-UHFFFAOYSA-N
- InChI: InChI=1S/C10H13NO4/c1-4-15-10(14)7-5(2)8(9(12)13)11-6(7)3/h11H,4H2,1-3H3,(H,12,13)
| 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 |
| Bolling_Point: | 424.6±45.0 °C at 760 mmHg |
|---|---|
| MF: | C10H13NO4 |
| Density: | 1.3±0.1 g/cm3 |
| FW: | 211.214 |
| Product_Name: | 4-(Ethoxycarbonyl)-3,5-Dimethyl-1H-Pyrrole-2-Carboxylic Acid |
| CAS: | 5442-91-1 |
| Flash_Point: | 210.6±28.7 °C |
| Melting_Point: | N/A |
| Vapor_Pressure: | 0.0±1.1 mmHg at 25°C |
|---|---|
| Bolling_Point: | 424.6±45.0 °C at 760 mmHg |
| MF: | C10H13NO4 |
| Density: | 1.3±0.1 g/cm3 |
| Refractive_Index: | 1.555 |
| Exact_Mass: | 211.084457 |
| PSA: | 79.39000 |
| LogP: | 2.65 |
| Flash_Point: | 210.6±28.7 °C |
| Computational_Chemistry: | ['1. XlogP :16 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :10 ', '6. TPSA :794 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :266 ', '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'] |
| FW: | 211.214 |
| HS_Code: | 2933990090 |
|---|