1-Isoquinolinecarbonitrile
Catalog No: FT-0627508
CAS No: 1198-30-7
- Chemical Name: 1-Isoquinolinecarbonitrile
- Molecular Formula: C10H6N2
- Molecular Weight: 154.17
- InChI Key: HJHXYSBRTVFEDD-UHFFFAOYSA-N
- InChI: InChI=1S/C10H6N2/c11-7-10-9-4-2-1-3-8(9)5-6-12-10/h1-6H
| 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: | 90-92 °C(lit.) |
|---|---|
| CAS: | 1198-30-7 |
| MF: | C10H6N2 |
| Flash_Point: | 121.6±5.6 °C |
| Product_Name: | 1-Isoquinolinecarbonitrile |
| Density: | 1.2±0.1 g/cm3 |
| FW: | 154.168 |
| Bolling_Point: | 348.9±15.0 °C at 760 mmHg |
| Refractive_Index: | 1.654 |
|---|---|
| Vapor_Pressure: | 0.0±0.8 mmHg at 25°C |
| Flash_Point: | 121.6±5.6 °C |
| LogP: | 1.74 |
| Bolling_Point: | 348.9±15.0 °C at 760 mmHg |
| PSA: | 36.68000 |
| Molecular_Structure: | ['1 . Molar refractive index 4667 ', '2 . Molar volume 1272 ', '3 张比容(902K)3534 ', '4 . Surface tension :594 ', '5 . Dielectric constant 无可用 ', '6 偶极距(10-24cm3)无可用 ', '7 . Polarizability 1850'] |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 367 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :203 ', '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: | 90-92 °C(lit.) |
| MF: | C10H6N2 |
| Exact_Mass: | 154.053101 |
| FW: | 154.168 |
| Density: | 1.2±0.1 g/cm3 |
| More_Info: | ['1 . Appearance 针状结晶 ', '2 . Density(g/cm3,20℃)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)92-93 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC,15mmHg)Unknow ', '7 . Refractive index(n20/D)Unknow ', '8 . Flash point(ºC)Unknow ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(psi,55ºC)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 Soluble in Ethanol and Ethyl ether ,Water 解得to 异喹哪啶酸'] |
| Hazard_Class: | 6.1 |
|---|---|
| Risk_Statements(EU): | R20/21/22;R36/37/38 |
| WGK_Germany: | 3 |
| RIDADR: | 3276 |
| Hazard_Codes: | Xn:Harmful; |
| HS_Code: | 2933499090 |
| Safety_Statements: | S26-S37/39 |
| Packing_Group: | III |
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