Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
2-운데실이미다졸
2-운데실-1H-이미다졸 · 2-운데실이미다졸 · 2-N-운데실이미다졸 · 2-UNDECYLIMIDAZOLE · Undecylimidazole · Einecs 240-796-9 · 2-N-UNDECYLIMIDAZOLE · 2-undecyl-1h-imidazol
식별자 및 물리적 특성
| CAS No. | 16731-68-3 |
|---|---|
| 분자식 | C14H26N2 |
| 평균 분자량 | 222.37 g/mol |
| 단동위원소 질량 | 222.20959884 g/mol |
| SMILES | CCCCCCCCCCCc1ncc[nH]1 |
| InChIKey | LLEASVZEQBICSN-UHFFFAOYSA-N |
| PubChem CID | 85582 |
| EC No. | 240-796-9 |
| DTXSID | DTXSID5066114 |
| 현지명 | 2-운데실이미다졸 |
화학 및 물리적 성질
| XLogP | 5.6 |
|---|---|
| 극성 표면적 | 28.7 |
| 수소 결합 공여자 수 | 1 |
| 수소 결합 수용자 수 | 1 |
| 회전 가능 결합 수 | 10 |
| 무거운 원자 수 | 16 |
| 형식 전하 | 0 |
| 복잡도 | 148 |
| 녹는점 | 69-74 °C (dec.)(lit.) |
| 끓는 점 | 215 °C20 mm Hg(lit.) |
| 밀도 | 0.9700 (rough estimate) |
| 굴절률 | 1.4750 (estimate) |
| 용해도 | 메탄올에 용해됨 |
| 물리적 상태 | powder to crystal |
| pKa(산도 계수) | 14.40±0.10(Predicted) |
| 색상 | 흰색에서 거의 흰색 |
| InChI | InChI=1S/C14H26N2/c1-2-3-4-5-6-7-8-9-10-11-14-15-12-13-16-14/h12-13H,2-11H2,1H3,(H,15,16) |
| InChIKey | LLEASVZEQBICSN-UHFFFAOYSA-N |
| SMILES | C1(CCCCCCCCCCC)NC=CN=1 |
| EPA | 1H-Imidazole, 2-undecyl- (16731-68-3) |
안전 및 규제
| GHS 분류 | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (98.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract 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 80 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| 규제 정보 | Chemical: 1H-Imidazole, 2-undecyl-1H-Imidazole, 2-undecyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
| Hazard Classes and Categories | Skin Irrit. 2 (100%)Eye Irrit. 2 (100%)STOT SE 3 (98.8%) |
| 수질 위해 등급(WGK) | 3 |
| TSCA 등재 상태 | TSCA listed |
| 관세 코드 | 2933.29.9000 |
| 위험 문구(R) | 36/37/38 |
| 위험 표시 | Xi |
| 안전 문구(S) | 26-36 |
| 기존화학 물질 | KE-35116 |
용도
용도
2-n-undecylimidazole is an important organic compound that can be used as a catalyst for the synthesis of high thermal conductive composite membranes.