기본 정보
- 표준 SMILES
c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1- InChIKey
RNIPJYFZGXJSDD-UHFFFAOYSA-N- 분자식
- C21H16N2
- 평균 분자량
- 296.4 g/mol
- 단동위원소 질량
- 296.13134852
이름 및 식별자
- 우선 이름
- 2,4,5-Triphenylimidazole
- IUPAC
- 2,4,5-triphenyl-1H-imidazole
- 현지명
- 2,4,5-트리페닐이미다졸
- 영어명
- 2,4,5-Triphenylimidazole
- 분자식
- C21H16N2
- 분자량
- 296.37
이름 및 동의어
2,4,5-Triphenylimidazole484-47-9LophineIMIDAZOLE, 2,4,5-TRIPHENYL-Q6K46G80ZDNSC-62790DTXSID3022039RefChem:154070DTXCID702039207-606-62,4,5-Triphenyl-1H-imidazoleLophin
이름 더 보기
2,4,5-트라이페닐이미다졸2,4,5-트리페닐이미다졸Oxaprozin Lophine2,4,5-triphenyl-imidazol2,4,5-triphenyl-1h-imidazol2,4,5-Triphenylimidazole,98%2,4,5-Trisphenyl-1H-imidazole1H-Imidazole,2,4,5-triphenyl-
1H-Imidazole, 2,4,5-triphenyl-2,4,5-Triphenyl-1,3-imidazoleC21H16N2MFCD00005187CHEMBL341732,5-TriphenylimidazoleImidazole,4,5-triphenyl-1H-Imidazole,4,5-triphenyl-
데이터베이스 식별자
- CAS
484-47-9- PubChem CID
- 10232
- DTXSID
DTXSID3022039- ChEMBL
CHEMBL34173- UNII
- Q6K46G80ZD
- EC Number
- 207-606-6
- Nikkaji
- J1.549K
물성
구조 계산 물성
- XLogP
- 5
- 극성 표면적
- 28.7 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 23
- 형식 전하
- 0
- 복잡도
- 351
물리화학적 성질
- 녹는점
- 274 · 274-278 °C (lit.)
- 끓는 점
- 427.96 °C · 427.96°C (rough estimate)
- 밀도
- 1.0874 · 1.0874 (rough estimate)
- 굴절률
- 1.8 · 1.8000 (estimate)
- 저장 조건
- Sealed in dry,Room Temperature
- 산도 계수 (pKa)
- 11.66 · 11.66±0.10(Predicted)
- 물리적 상태
- powder to crystal
- 색상
- White to Orange to Green
- 수용성
- 메탄올에 용해됩니다. 물에 불용성.
- BRN
- 236652 · 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
- 1 H-Imidazole, · 1H-Imidazole, 2,4,5-triphenyl- (484-47-9)
화학적 성질
OFF-WHITE POWDER
안전 및 규제
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- NI8710000
- HS 번호
- 29349990
- safety_code
- 22-24/25
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도2,4,5-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 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
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