(2S)-3-(1-benzylimidazol-4-yl)-2-(phenylmethoxycarbonylamino)propanoic acid
Catalog No: FT-0772549
CAS No: 21929-66-8
- Chemical Name: (2S)-3-(1-benzylimidazol-4-yl)-2-(phenylmethoxycarbonylamino)propanoic acid
- Molecular Formula: C21H21N3O4
- Molecular Weight: 379.4
- InChI Key: RSDRIMXAOFFQMC-IBGZPJMESA-N
- InChI: InChI=1S/C21H21N3O4/c25-20(26)19(23-21(27)28-14-17-9-5-2-6-10-17)11-18-13-24(15-22-18)12-16-7-3-1-4-8-16/h1-10,13,15,19H,11-12,14H2,(H,23,27)(H,25,26)/t19-/m0/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: | 379.409 |
| CAS: | 21929-66-8 |
| MF: | C21H21N3O4 |
| Flash_Point: | 346.5±31.5 °C |
| Product_Name: | 1-Benzyl-N-[(benzyloxy)carbonyl]-L-histidine |
| Bolling_Point: | 649.3±55.0 °C at 760 mmHg |
| Density: | 1.3±0.1 g/cm3 |
| FW: | 379.409 |
|---|---|
| Refractive_Index: | 1.613 |
| Vapor_Pressure: | 0.0±2.0 mmHg at 25°C |
| MF: | C21H21N3O4 |
| Exact_Mass: | 379.153198 |
| LogP: | 2.82 |
| Bolling_Point: | 649.3±55.0 °C at 760 mmHg |
| Density: | 1.3±0.1 g/cm3 |
| PSA: | 93.45000 |
| Computational_Chemistry: | ['1. XlogP :27 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :9 ', '5. Isotope Atom Count :2 ', '6. TPSA :934 ', '7. Heavy Atom Count :28 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :504 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '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: | 346.5±31.5 °C |
| RIDADR: | NONH for all modes of transport |
|---|---|
| HS_Code: | 2933290090 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
