Metrizoic Acid
Catalog No: FT-0672392
CAS No: 1949-45-7
- Chemical Name: Metrizoic Acid
- Molecular Formula: C12H11I3N2O4
- Molecular Weight: 627.94
- InChI Key: GGGDNPWHMNJRFN-UHFFFAOYSA-N
- InChI: InChI=1S/C12H11I3N2O4/c1-4(18)16-10-7(13)6(12(20)21)8(14)11(9(10)15)17(3)5(2)19/h1-3H3,(H,16,18)(H,20,21)
| 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 |
| Product_Name: | metrizoic acid |
|---|---|
| Flash_Point: | 364.3ºC |
| Melting_Point: | N/A |
| FW: | 627.94000 |
| Density: | 2.483g/cm3 |
| CAS: | 1949-45-7 |
| Bolling_Point: | 678.8ºC at 760mmHg |
| MF: | C12H11I3N2O4 |
| Density: | 2.483g/cm3 |
|---|---|
| Computational_Chemistry: | ['1. XlogP :19 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :3 ', '6. TPSA 867 ', '7. Heavy Atom Count :21 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :448 ', '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'] |
| LogP: | 3.21270 |
| Flash_Point: | 364.3ºC |
| Refractive_Index: | 1.77 |
| FW: | 627.94000 |
| PSA: | 86.71000 |
| MF: | C12H11I3N2O4 |
| Bolling_Point: | 678.8ºC at 760mmHg |
| Vapor_Pressure: | 2.35E-19mmHg at 25°C |
| Exact_Mass: | 627.78500 |
| RTECS: | DG0887300 |
|---|---|
| Risk_Statements(EU): | 36/37/38 |
| HS_Code: | 2924299090 |
| Safety_Statements: | S26-S36/37/39 |
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