4-(Methylsulphonyl)benzoic acid
Catalog No: FT-0600628
CAS No: 4052-30-6
- Chemical Name: 4-(Methylsulphonyl)benzoic acid
- Molecular Formula: C8H8O4S
- Molecular Weight: 200.21
- InChI Key: AJBWNNKDUMXZLM-UHFFFAOYSA-N
- InChI: InChI=1S/C8H8O4S/c1-13(11,12)7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,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 |
| Symbol: | GHS07 |
|---|---|
| CAS: | 4052-30-6 |
| Flash_Point: | 215.3±26.5 °C |
| Product_Name: | 4-Methylsulfonyl benzoic acid |
| Bolling_Point: | 432.4±37.0 °C at 760 mmHg |
| FW: | 200.212 |
| Melting_Point: | 268-271 °C(lit.) |
| MF: | C8H8O4S |
| Density: | 1.4±0.1 g/cm3 |
| Refractive_Index: | 1.560 |
|---|---|
| Vapor_Pressure: | 0.0±1.1 mmHg at 25°C |
| Flash_Point: | 215.3±26.5 °C |
| LogP: | 0.67 |
| Bolling_Point: | 432.4±37.0 °C at 760 mmHg |
| Water_Solubility: | slight |
| FW: | 200.212 |
| PSA: | 79.82000 |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 798 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :280 ', '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: | 268-271 °C(lit.) |
| MF: | C8H8O4S |
| Exact_Mass: | 200.014328 |
| Density: | 1.4±0.1 g/cm3 |
| Symbol: | GHS07 |
|---|---|
| Risk_Statements(EU): | R22 |
| HS_Code: | 2916399090 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
| RIDADR: | NONH for all modes of transport |
| Hazard_Codes: | Xn: Harmful;Xi: Irritant; |
| Warning_Statement: | P305 + P351 + P338 |
| Safety_Statements: | H302-H319 |
