5-tert-Butoxycarbonylamino-2-chloro-isonicotinic acid
Catalog No: FT-0682827
CAS No: 171178-46-4
- Chemical Name: 5-tert-Butoxycarbonylamino-2-chloro-isonicotinic acid
- Molecular Formula: C11H13ClN2O4
- Molecular Weight: 272.68 g/mol
- InChI Key: KOSPRFUMGCNGFJ-UHFFFAOYSA-N
- InChI: InChI=1S/C11H13ClN2O4/c1-11(2,3)18-10(17)14-7-5-13-8(12)4-6(7)9(15)16/h4-5H,1-3H3,(H,14,17)(H,15,16)
| 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: | 2-chloro-5-[(2-methylpropan-2-yl)oxycarbonylamino]pyridine-4-carboxylic acid |
|---|---|
| Flash_Point: | 208.2±28.7 °C |
| Melting_Point: | N/A |
| FW: | 272.685 |
| Density: | 1.4±0.1 g/cm3 |
| CAS: | 171178-46-4 |
| Bolling_Point: | 420.6±45.0 °C at 760 mmHg |
| MF: | C11H13ClN2O4 |
| Molecular_Structure: | ['1 . Molar refractive index 6605 ', '2 . Molar volume 1961 ', '3 . Parachor (902K)5372 ', '4 . Surface tension 562 ', '5 . Polarizability 2618'] |
|---|---|
| LogP: | 4.38 |
| Flash_Point: | 208.2±28.7 °C |
| Refractive_Index: | 1.588 |
| FW: | 272.685 |
| Density: | 1.4±0.1 g/cm3 |
| Bolling_Point: | 420.6±45.0 °C at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :25 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :4 ', '6. TPSA 885 ', '7. Heavy Atom Count :18 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :330 ', '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'] |
| PSA: | 88.52000 |
| Exact_Mass: | 272.056396 |
| Vapor_Pressure: | 0.0±1.0 mmHg at 25°C |
| MF: | C11H13ClN2O4 |
| HS_Code: | 2933399090 |
|---|
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