1,1'-DI-N-헵틸-4,4'-비피리디늄디브로마이드
1,1'-DI-N-헵틸-4,4'-비피리디늄디브로마이드 · DHBP DIBROMIDE · forelectrochromicmaterial · DIHEPTYLVIOLOGEN DIBROMIDE · DHBP dibromide, 10 mM in DMSO · 4,4'-Bi[1-heptylpyridinium]·2bromide · 1,1'-Diheptyl-4,4'-bipyridinium·2bromide · 1,1'-DI-N-HEPTYL-4,4'-BIPYRIDINIUM DIBRO
식별자 및 물리적 특성
| CAS No. | 6159-05-3 |
|---|---|
| 분자식 | C24H38Br2N2 |
| 평균 분자량 | 514.4 g/mol |
| 단동위원소 질량 | 512.14017342 g/mol |
| SMILES | CCCCCCC[n+]1ccc(-c2cc[n+](CCCCCCC)cc2)cc1.[Br-].[Br-] |
| InChIKey | VRXAJMCFEOESJO-UHFFFAOYSA-L |
| PubChem CID | 80262 |
| EC No. | 228-178-7 |
| DTXSID | DTXSID90889503 |
| 현지명 | 1,1'-DI-N-헵틸-4,4'-비피리디늄디브로마이드 |
화학 및 물리적 성질
| 극성 표면적 | 7.8 |
|---|---|
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 2 |
| 회전 가능 결합 수 | 13 |
| 무거운 원자 수 | 28 |
| 형식 전하 | 0 |
| 복잡도 | 282 |
| 농약 | Pesticides -> Herbicides, Bipyridyl |
| Physical Description | Yellow hygroscopic solid[Aldrich MSDS] |
| 녹는점 | 285 °C (dec.) (lit.) |
| 밀도 | 1.2527 (rough estimate) |
| 굴절률 | 1.6800 (estimate) |
| 저장 조건 | Inert atmosphere,Room Temperature |
| 용해도 | 물에 용해됨 |
| 물리적 상태 | powder to crystal |
| 색상 | Light yellow to Amber to Dark green |
| InChI | InChI=1S/C24H38N2.BrH/c1-3-5-7-9-11-17-25-19-13-23(14-20-25)24-15-21-26(22-16-24)18-12-10-8-6-4-2/h13-16,19-22H,3-12,17-18H2,1-2H31H/q+2/p-1 |
| InChIKey | LRJNRMNPNGPKMG-UHFFFAOYSA-M |
| SMILES | C([N+]1=CC=C(C2=CC=[N+](CCCCCCC)C=C2)C=C1)CCCCCC.[Br-] |
| EPA | 4,4'-Bipyridinium, 1,1'-diheptyl-, dibromide (6159-05-3) |
화학적 성질
yellow to yellow-green powder or flakes
안전 및 규제
| GHS 분류 | WarningH315 (97.5%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| 유해성 요약 | A skin and strong eye irritant[Aldrich MSDS] See Paraquat dichloride. |
| Hazard Classes and Categories | Skin Irrit. 2 (97.5%) |
| 수질 위해 등급(WGK) | 3 |
| TSCA 등재 상태 | TSCA listed |
| 관세 코드 | 2933.39.9200 |
| 위험 문구(R) | 36/37/38 |
| 위험 표시 | Xi |
| 안전 문구(S) | 26-37/39 |
| 위험 등급 | Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
| 저장 분류 | 11 - Combustible Solids |
용도
용도
DHBP is an EC material which can be used in the fabrication of electronic devices such as organic light emitting diodes (OLED), supercapacitors, and liquid crystal displays (LCDs).
일반 설명
1,1′-Diheptyl-4,4′-bipyridinium dibromide (DHBP) is a heptyl viologen that can be used as an electrochromic (EC) material. It forms a highly efficient quenching system for conjugated polyelectrolyte for the development of organic electronics. It also acts as a redox active electrolyte for electrochemical devices (ECDs).