4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBONITRILE
Catalog No: FT-0617441
CAS No: 770-30-9
- Chemical Name: 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBONITRILE
- Molecular Formula: C6H6N4S
- Molecular Weight: 166.21
- InChI Key: VYDHBDPZNLVELI-UHFFFAOYSA-N
- InChI: InChI=1S/C6H6N4S/c1-11-6-9-3-4(2-7)5(8)10-6/h3H,1H3,(H2,8,9,10)
| 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: | 240-242 °C |
|---|---|
| CAS: | 770-30-9 |
| MF: | C6H6N4S |
| Flash_Point: | 183.4ºC |
| Product_Name: | 4-Amino-2-(Methylthio)Pyrimidine-5-Carbonitrile |
| Density: | 1.37g/cm3 |
| FW: | 166.20400 |
| Bolling_Point: | 379.7ºC at 760 mmHg |
| Refractive_Index: | 1.627 |
|---|---|
| Flash_Point: | 183.4ºC |
| LogP: | 1.23358 |
| Bolling_Point: | 379.7ºC at 760 mmHg |
| PSA: | 100.89000 |
| Molecular_Structure: | ['1 . Molar refractive index 4317 ', '2 . Molar volume （m3/mol）1194 ', '3 . Parachor （902K）3627 ', '4 . Surface tension 849 ', '5 . Dielectric constant ', '6 偶极距（10 -24cm 3） ', '7 . Polarizability 1711'] |
| Computational_Chemistry: | ['1. XlogP :1 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :3 ', '6. TPSA 101 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :175 ', '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: | 240-242 °C |
| MF: | C6H6N4S |
| Exact_Mass: | 166.03100 |
| FW: | 166.20400 |
| Density: | 1.37g/cm3 |
| More_Info: | ['1 . Appearance Unknow ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）240-242 °C ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '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'] |
| Hazard_Class: | 6.1 |
|---|---|
| Risk_Statements(EU): | 36/37/38-20/21/22 |
| RIDADR: | 3276 |
| Hazard_Codes: | Xn,Xi |
| HS_Code: | 2933599090 |
| Safety_Statements: | S36/37/39-S26-S22 |
| Packing_Group: | III |
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