Daltroban
Catalog No: FT-0603138
CAS No: 79094-20-5
- Chemical Name: Daltroban
- Molecular Formula: C16H16ClNO4S
- Molecular Weight: 353.8
- InChI Key: IULOBWFWYDMECP-UHFFFAOYSA-N
- InChI: InChI=1S/C16H16ClNO4S/c17-14-5-7-15(8-6-14)23(21,22)18-10-9-12-1-3-13(4-2-12)11-16(19)20/h1-8,18H,9-11H2,(H,19,20)
| 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 |
| Bolling_Point: | 555.3ºC at 760 mmHg |
|---|---|
| CAS: | 79094-20-5 |
| MF: | C16H16ClNO4S |
| Melting_Point: | 132.5-137.4 °C(lit.) |
| Symbol: | Warning |
| Density: | 1.378g/cm3 |
| FW: | 353.82100 |
| Product_Name: | Daltroban |
| Flash_Point: | 289.6ºC |
| Bolling_Point: | 555.3ºC at 760 mmHg |
|---|---|
| Vapor_Pressure: | 3.63E-13mmHg at 25°C |
| LogP: | 3.95980 |
| Computational_Chemistry: | ['1. XlogP :29 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :7 ', '5. Isotope Atom Count :N/A ', '6. TPSA 918 ', '7. Heavy Atom Count :23 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :475 ', '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: | 132.5-137.4 °C(lit.) |
| Exact_Mass: | 353.04900 |
| MF: | C16H16ClNO4S |
| Density: | 1.378g/cm3 |
| Refractive_Index: | 1.609 |
| PSA: | 91.85000 |
| Flash_Point: | 289.6ºC |
| Molecular_Structure: | ['1 . Molar refractive index 8892 ', '2 . Molar volume 2566 ', '3 . Parachor （902K）7031 ', '4 . Surface tension 563 ', '5 . Polarizability 3525'] |
| FW: | 353.82100 |
| WGK_Germany: | 3 |
|---|---|
| Symbol: | Warning |
| Safety_Statements: | S26-S36/37 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
| Warning_Statement: | P261-P305 + P351 + P338 |
| RIDADR: | NONH for all modes of transport |
| Risk_Statements(EU): | R36/37/38 |
| Hazard_Codes: | Xi:Irritant; |
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