HuagongsheHuagongshe Chemistry Print Report · For research reference only
Methyl 3-(1-Tritylimidazol-4-yl) Propionate
methyl 3-(1-trityl-1H-imidazol-4-yl)propanoate · 1-(Triphenylmethyl)-1H-imidazole-4-propanoic Acid Methyl Ester · 3-(1-triphenylmethyl-1H-imidazol-4-yl)propanoic acid methyl ester · 1H-Imidazole-4-propanoic acid, 1-(triphenylmethyl)-, methyl ester · 3-(1-Triphenylmethyl-1H-imidazol-4-yl)propionic Acid Methyl Ester
Identifiers & Physical Properties
| CAS No. | 102676-60-8 |
|---|---|
| Molecular formula | C26H24N2O2 |
| Average molar mass | 396.5 g/mol |
| Monoisotopic mass | 396.18377801 g/mol |
| SMILES | COC(=O)CCc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1 |
| InChIKey | FSUWVSSCCGVYLS-UHFFFAOYSA-N |
| PubChem CID | 10475868 |
| DTXSID | DTXSID10440579 |
Chemical & Physical Properties
| XLogP | 4.9 |
|---|---|
| Topological polar surface area | 44.1 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 8 |
| Heavy atoms | 30 |
| Formal charge | 0 |
| Complexity | 488 |
| Melting point | 140-142°C |
| Boiling point | 531.0±45.0 °C(Predicted) |
| Density | 1.09±0.1 g/cm3(Predicted) |
| Storage conditions | -20°C Freezer |
| Solubility | soluble in Dichloromethane, Ethyl Acetate, Methanol |
| pKa (acidity coefficient) | 6.04±0.61(Predicted) |
| Physical state | Solid |
| Color | White to Off-White |
| CAS DataBase Reference | 102676-60-8 |
| GHS pictogram | GHS07 |
| Signal word | Warning |
| GHS hazard statements | H302-H315-H319-H335 |
| GHS precautionary statements | P280-P305+P351+P338 |
Safety & Regulations
| Signal word | Warning |
|---|---|
| GHS pictogram | GHS07 |
| GHS hazard statements | H302-H315-H319-H335 |
| GHS precautionary statements | P280-P305+P351+P338 |
Applications & Uses
Uses
Methyl 3-(1-Tritylimidazol-4-yl) Propionate (cas# 102676-60-8) is a compound useful in organic synthesis.