Isoquinoline-1-carboxylic acid
Catalog No: FT-0607986
CAS No: 486-73-7
- Molecular Formula: 173.17
- Formula Weight: C10H7NO2
- Inchl Key: XAAKCCMYRKZRAK-UHFFFAOYSA-N
- Inchl: InChI=1S/C10H7NO2/c12-10(13)9-8-4-2-1-3-7(8)5-6-11-9/h1-6H,(H,12,13)
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Bolling_Point: | 405.6±18.0 °C at 760 mmHg |
|---|---|
| MF: | C10H7NO2 |
| Density: | 1.3±0.1 g/cm3 |
| FW: | 173.168 |
| Product_Name: | 1-Isoquinolinecarboxylic acid |
| CAS: | 486-73-7 |
| Flash_Point: | 199.1±21.2 °C |
| Melting_Point: | 164 °C (dec.)(lit.) |
| Bolling_Point: | 405.6±18.0 °C at 760 mmHg |
|---|---|
| Vapor_Density: | 3.59 (vs air) |
| LogP: | 1.13 |
| More_Info: | ['1 . Appearance Unknow ', '2 . Density（g/ m3,25/4℃）0932 ', '3 . Relative vapor density（g/cm3,Atmosphere =1）359 ', '4 . Melting point（ºC）164 ', '5 . Boiling point（ºC,Atmospheric pressure）69-69 ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive index1358 ', '8 . Flash point（ºF）8 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow'] |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 502 ', '7. Heavy Atom Count :13 ', '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'] |
| Melting_Point: | 164 °C (dec.)(lit.) |
| Vapor_Pressure: | 0.0±1.0 mmHg at 25°C |
| Exact_Mass: | 173.047684 |
| MF: | C10H7NO2 |
| Density: | 1.3±0.1 g/cm3 |
| Refractive_Index: | 1.685 |
| PSA: | 50.19000 |
| Flash_Point: | 199.1±21.2 °C |
| Molecular_Structure: | ['1 . Molar refractive index 2461 ', '2 . Molar volume （m3/mol）1190 ', '3 . Parachor （902K）2474 ', '4 表面张力（30 dyne/cm）186 ', '5 . Polarizability （05 10 -24cm 3）975'] |
| FW: | 173.168 |
| Safety_Statements: | S22-S24/25-S45-S36/37/39-S27-S16 |
|---|---|
| RIDADR: | UN 2416 3/PG 2 |
| WGK_Germany: | 3 |
| Hazard_Codes: | Xn,Xi,T,F |
| RTECS: | ED5600000 |
| HS_Code: | 29334990 |
| Risk_Statements(EU): | R11 |
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