![(2S,5R,6R)-6-[[2-(3,4-dichlorophenyl)-2-methoxyacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (CAS: 1926-49-4) - Chemical Structure and Molecular Formula](/static/img/prod_pic/FT-0773917.png "(2S,5R,6R)-6-[[2-(3,4-dichlorophenyl)-2-methoxyacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid chemical structure")
(2S,5R,6R)-6-[[2-(3,4-dichlorophenyl)-2-methoxyacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Catalog No: FT-0773917
CAS No: 1926-49-4
- Chemical Name: (2S,5R,6R)-6-[[2-(3,4-dichlorophenyl)-2-methoxyacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
- Molecular Formula: C17H18Cl2N2O5S
- Molecular Weight: 433.3
- InChI Key: JKXQBIZCQJLVOS-GSNLGQFWSA-N
- InChI: InChI=1S/C17H18Cl2N2O5S/c1-17(2)12(16(24)25)21-14(23)10(15(21)27-17)20-13(22)11(26-3)7-4-5-8(18)9(19)6-7/h4-6,10-12,15H,1-3H3,(H,20,22)(H,24,25)/t10-,11?,12+,15-/m1/s1
| 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 |
| Melting_Point: | N/A |
|---|---|
| FW: | 433.30600 |
| CAS: | 1926-49-4 |
| MF: | C17H18Cl2N2O5S |
| Flash_Point: | 373ºC |
| Product_Name: | (2S,5R,6R)-6-[[2-(3,4-dichlorophenyl)-2-methoxyacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid |
| Bolling_Point: | 693.1ºC at 760mmHg |
| Density: | 1.54g/cm3 |
| FW: | 433.30600 |
|---|---|
| Refractive_Index: | 1.652 |
| Vapor_Pressure: | 3.6E-20mmHg at 25°C |
| MF: | C17H18Cl2N2O5S |
| Exact_Mass: | 432.03100 |
| LogP: | 2.64140 |
| Bolling_Point: | 693.1ºC at 760mmHg |
| Density: | 1.54g/cm3 |
| PSA: | 121.24000 |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :4 ', '6. TPSA :121 ', '7. Heavy Atom Count :27 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :649 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :3 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| Flash_Point: | 373ºC |
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