Benzethonium chloride
Catalog No: FT-0622657
CAS No: 121-54-0
- Molecular Formula: 448.1
- Formula Weight: C27H42ClNO2
- Inchl Key: UREZNYTWGJKWBI-UHFFFAOYSA-M
- Inchl: InChI=1S/C27H42NO2.ClH/c1-26(2,3)22-27(4,5)24-13-15-25(16-14-24)30-20-19-29-18-17-28(6,7)21-23-11-9-8-10-12-23;/h8-16H,17-22H2,1-7H3;1H/q+1;/p-1
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Symbol: | GHS05, GHS06, GHS09 |
|---|---|
| CAS: | 121-54-0 |
| Flash_Point: | N/A |
| Product_Name: | benzethonium chloride |
| Bolling_Point: | N/A |
| FW: | 448.081 |
| Melting_Point: | 162-164 °C(lit.) |
| MF: | C27H42ClNO2 |
| Density: | 0.998 g/mL at 20 °C |
| LogP: | 6.87440 |
|---|---|
| Water_Solubility: | 1-5 g/100 mL at 18 ºC |
| FW: | 448.081 |
| PSA: | 18.46000 |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :12 ', '5. Isotope Atom Count :N/A ', '6. TPSA 185 ', '7. Heavy Atom Count :31 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :466 ', '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 :2'] |
| Melting_Point: | 162-164 °C(lit.) |
| MF: | C27H42ClNO2 |
| Exact_Mass: | 447.290405 |
| Density: | 0.998 g/mL at 20 °C |
| More_Info: | ['1 . Appearance Colourless 六方片状结晶 ', '2 . Melting point（℃）164-166 ', '3 PH值（1%Water 溶液）48-55 ', '4 Water 溶性（g/100mL,18 ºC）1-5'] |
| Symbol: | GHS05, GHS06, GHS09 |
|---|---|
| RIDADR: | UN1759 |
| HS_Code: | 2942000000 |
| Packing_Group: | III |
| Hazard_Class: | 8 |
| Risk_Statements(EU): | R22;R36 |
| WGK_Germany: | 2 |
| Personal_Protective_Equipment: | Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges |
| RTECS: | BO7175000 |
| Hazard_Codes: | Xn:Harmful |
| Warning_Statement: | P273-P280-P301 + P310-P305 + P351 + P338-P310-P501 |
| Safety_Statements: | H301-H314-H410 |
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