Catalog NumberNZs1871767
CAS Number1871-76-7
CategoryBuilding-Block Reagents for Supramolecular Catalysis
| Description | Diphenylacetyl chloride is an aromatic acyl chloride featuring two phenyl rings attached to an acetyl chloride moiety. Its electrophilic carbonyl chloride group allows for efficient acylation and derivatization reactions. |
| Synonyms | Diphenylacetyl chloride |
| IUPAC Name | 2,2-diphenylacetyl chloride |
| Molecular Weight | 230.69 |
| Molecular Formula | (C6H5)2CHCOCl |
| Canonical SMILES | ClC(=O)C(c1ccccc1)c2ccccc2 |
| InChI | 1S/C14H11ClO/c15-14(16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H |
| InChI Key | MSYLETHDEIJMAF-UHFFFAOYSA-N |
| Boiling Point | 175-176 °C/17 mmHg (lit.) |
| Melting Point | 49-53 °C (lit.) |
| Flash Point | 113 °C - closed cup |
| Purity | 0.99 |
| Appearance | Crystals or powder or crystalline |
| Application | It is commonly used as a capping reagent or functional group modifier in supramolecular synthesis. The compound enables the introduction of bulky hydrophobic end groups, enhancing host cavity rigidity, selectivity, and overall stability of macrocyclic frameworks. |
| Color | White to pale cream or pale yellow to yellow to pale brown or pale pink to pale gray |
| EC Number | 217-493-5 |
| Exact Mass | 230.0498427 Da |
| MDL Number | MFCD00013655 |
| Monoisotopic Mass | 230.0498427 Da |
| Pubchem CID | 24859978 |
| Storage Conditions | It is recommended to store this product at room temperature in a cool, dry place, <15°C. |
| WGK Germany | 2 |
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