1H-1,2,4-Triazole-3-carboxylic acid
Catalog No: FT-0600896
CAS No: 4928-87-4
- Molecular Formula: 113.08
- Formula Weight: C3H3N3O2
- Inchl Key: LJVQHXICFCZRJN-UHFFFAOYSA-N
- Inchl: InChI=1S/C3H3N3O2/c7-3(8)2-4-1-5-6-2/h1H,(H,7,8)(H,4,5,6)
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Melting_Point: | 132-136ºC |
|---|---|
| CAS: | 4928-87-4 |
| MF: | C3H3N3O2 |
| Flash_Point: | 222.7±24.0 °C |
| Product_Name: | 1H-1,2,4-Triazole-3-carboxylic acid |
| Density: | 1.7±0.1 g/cm3 |
| FW: | 113.075 |
| Bolling_Point: | 444.6±28.0 °C at 760 mmHg |
| Refractive_Index: | 1.632 |
|---|---|
| Vapor_Pressure: | 0.0±1.1 mmHg at 25°C |
| Flash_Point: | 222.7±24.0 °C |
| LogP: | -1.24 |
| Bolling_Point: | 444.6±28.0 °C at 760 mmHg |
| FW: | 113.075 |
| PSA: | 78.87000 |
| Computational_Chemistry: | ['1. XlogP :-02 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :5 ', '6. TPSA :789 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :105 ', '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: | 132-136ºC |
| MF: | C3H3N3O2 |
| Exact_Mass: | 113.022530 |
| Density: | 1.7±0.1 g/cm3 |
| Safety_Statements: | S26-S36/37 |
|---|---|
| Hazard_Codes: | Xi:Irritant; |
| HS_Code: | 2933990090 |
| Risk_Statements(EU): | R36/37/38 |
| WGK_Germany: | 3 |
