2,4,5-트리페닐이미다졸
2,4,5-트라이페닐이미다졸 · 2,4,5-트리페닐이미다졸 · LOPHINE · Lophin · Oxaprozin Lophine · 2,4,5-TRIPHENYLIMIDAZOLE · 2,4,5-triphenyl-imidazol · 2,4,5-triphenyl-1h-imidazol
식별자 및 물리적 특성
| CAS No. | 484-47-9 |
|---|---|
| 분자식 | C21H16N2 |
| 평균 분자량 | 296.4 g/mol |
| 단동위원소 질량 | 296.13134852 g/mol |
| SMILES | c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1 |
| InChIKey | RNIPJYFZGXJSDD-UHFFFAOYSA-N |
| PubChem CID | 10232 |
| ChEMBL | CHEMBL34173 |
| EC No. | 207-606-6 |
| DTXSID | DTXSID3022039 |
| 현지명 | 2,4,5-트리페닐이미다졸 |
화학 및 물리적 성질
| XLogP | 5 |
|---|---|
| 극성 표면적 | 28.7 |
| 수소 결합 공여자 수 | 1 |
| 수소 결합 수용자 수 | 1 |
| 회전 가능 결합 수 | 3 |
| 무거운 원자 수 | 23 |
| 형식 전하 | 0 |
| 복잡도 | 351 |
| 녹는점 | 274-278 °C (lit.) |
| 끓는 점 | 427.96°C (rough estimate) |
| 밀도 | 1.0874 (rough estimate) |
| 굴절률 | 1.8000 (estimate) |
| 저장 조건 | Sealed in dry,Room Temperature |
| pKa(산도 계수) | 11.66±0.10(Predicted) |
| 물리적 상태 | powder to crystal |
| 색상 | White to Orange to Green |
| 용해도 | 메탄올에 용해됩니다. 물에 불용성. |
| BRN | 236652 |
| InChI | InChI=1S/C21H16N2/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)23-21(22-19)18-14-8-3-9-15-18/h1-15H,(H,22,23) |
| InChIKey | RNIPJYFZGXJSDD-UHFFFAOYSA-N |
| SMILES | C1(C2=CC=CC=C2)NC(C2=CC=CC=C2)=C(C2=CC=CC=C2)N=1 |
| EPA | 1H-Imidazole, 2,4,5-triphenyl- (484-47-9) |
화학적 성질
OFF-WHITE POWDER
안전 및 규제
| 수질 위해 등급(WGK) | 3 |
|---|---|
| TSCA 등재 상태 | TSCA listed |
| RTECS 번호 | NI8710000 |
| 관세 코드 | 29349990 |
| 안전 문구(S) | 22-24/25 |
| 저장 분류 | 11 - Combustible Solids |
용도
용도
2,4,5-Triphenylimidazole is used in the synthesis of fluorescent diarylethenes and nanowires of 2,4,5-triphenylimidazole, which finds application as single wire active optical waveguides and optically driven ultraviolet lasers.
제조 및 합성 방법
제조 방법
2,4,5-triphenylimidazole was synthesized by reaction between ammonia, benzaldehyde and benzoin: Benzoin (1) ( 5 g, 0.023 M) was reacted with benzaldehyde (5 mL, 0.05 mol) (2) in presence of ammonia (3) and refluxed for 4 h and the resulting mixture was cooled, filtered to get 2,4,5-triphenylimidazole (4).Synthesis of 2,4,5-Triphenylimidazoles Novel Mannich Bases as Potential Antiinflammatory and Analgesic AgentsDOI: 10.3923/crc.2012.99.109