4-Methyl-2-(methylsulfanyl)-5-pyrimidinecarboxylic acid
Catalog No: FT-0680305
CAS No: 98276-75-6
- Chemical Name: 4-Methyl-2-(methylsulfanyl)-5-pyrimidinecarboxylic acid
- Molecular Formula: C7H8N2O2S
- Molecular Weight: 184.22
- InChI Key: AOPKZVQATOWLNA-UHFFFAOYSA-N
- InChI: InChI=1S/C7H8N2O2S/c1-4-5(6(10)11)3-8-7(9-4)12-2/h3H,1-2H3,(H,10,11)
| 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: | 4-methyl-2-methylsulfanylpyrimidine-5-carboxylic acid |
|---|---|
| Flash_Point: | 183.5ºC |
| Melting_Point: | 169-171ºC |
| FW: | 184.21600 |
| Density: | 1.38g/cm3 |
| CAS: | 98276-75-6 |
| Bolling_Point: | 379.9ºC at 760mmHg |
| MF: | C7H8N2O2S |
| Molecular_Structure: | ['1 . Molar refractive index 4588 ', '2 . Molar volume 1330 ', '3 . Parachor （902K）3858 ', '4 . Surface tension 707 ', '5 . Polarizability 1819'] |
|---|---|
| LogP: | 1.20510 |
| Flash_Point: | 183.5ºC |
| Refractive_Index: | 1.606 |
| FW: | 184.21600 |
| Density: | 1.38g/cm3 |
| Bolling_Point: | 379.9ºC at 760mmHg |
| Computational_Chemistry: | ['1. XlogP :1 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 884 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :177 ', '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: | 169-171ºC |
| PSA: | 88.38000 |
| MF: | C7H8N2O2S |
| More_Info: | ['1 . Melting point（ºC）169~171'] |
| Exact_Mass: | 184.03100 |
| Hazard_Codes: | Xi: Irritant; |
|---|---|
| HS_Code: | 2933599090 |
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