6,8-DIHYDROXY-2-METHYLMERCAPTOPURINE
Catalog No: FT-0637083
CAS No: 14443-37-9
- Chemical Name: 6,8-DIHYDROXY-2-METHYLMERCAPTOPURINE
- Molecular Formula: C6H6N4O2S
- Molecular Weight: 198.21 g/mol
- InChI Key: ABNKHLJAVYVWBF-UHFFFAOYSA-N
- InChI: InChI=1S/C6H6N4O2S/c1-13-6-9-3-2(4(11)10-6)7-5(12)8-3/h1H3,(H3,7,8,9,10,11,12)
| 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 |
| FW: | 198.20200 |
|---|---|
| CAS: | 14443-37-9 |
| Melting_Point: | >300ºC |
| Bolling_Point: | 656.1ºC at 760 mmHg |
| MF: | C6H6N4O2S |
| Product_Name: | 2-methylsulfanyl-7,9-dihydro-3H-purine-6,8-dione |
| Flash_Point: | 350.6ºC |
| Density: | 1.99 g/cm3 |
| FW: | 198.20200 |
|---|---|
| MF: | C6H6N4O2S |
| Refractive_Index: | 1.914 |
| More_Info: | ['1 . Appearance White Solid ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '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）不适用的 ', '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'] |
| Vapor_Pressure: | 8.08E-18mmHg at 25°C |
| Bolling_Point: | 656.1ºC at 760 mmHg |
| Exact_Mass: | 198.02100 |
| PSA: | 120.22000 |
| Computational_Chemistry: | ['1. XlogP :-07 ', '2. Hydrogen Bond Donor Count :3 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :22 ', '6. TPSA 108 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :360 ', '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'] |
| Molecular_Structure: | ['1 . Molar refractive index 4732 ', '2 . Molar volume （m3/mol）1071 ', '3 . Parachor （902K）3794 ', '4 . Surface tension 1573 ', '5 . Polarizability 1876'] |
| LogP: | 0.48600 |
| Melting_Point: | >300ºC |
| Flash_Point: | 350.6ºC |
| Density: | 1.99 g/cm3 |
| Risk_Statements(EU): | R20/21/22 |
|---|---|
| HS_Code: | 2933990090 |
| Safety_Statements: | S22 |
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