Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
2-클로로-4-FLUOROIODOBENZENE
2-클로로-4-FLUOROIODOBENZENE · 2-CHLORO-4-FLUORO-1-IODOBENZENE · colorless liquid · 2-Chloro-4-fluoroiodo · 2-Chloro-4-fluoroiodobenzene · 3-Chloro-4-iodofluorobenzene · 4-Fluoro-2-chloroiodobenzene · 3-Chloro-1-fluoro-4-iodobenzene
식별자 및 물리적 특성
| CAS No. | 101335-11-9 |
|---|---|
| 분자식 | C6H3ClFI |
| 평균 분자량 | 256.44 g/mol |
| 단동위원소 질량 | 255.895204 g/mol |
| SMILES | Fc1ccc(I)c(Cl)c1 |
| InChIKey | POTCKVPDYXEGSV-UHFFFAOYSA-N |
| PubChem CID | 2736559 |
| EC No. | 600-191-6 |
| DTXSID | DTXSID20371441 |
| 현지명 | 2-클로로-4-FLUOROIODOBENZENE |
화학 및 물리적 성질
| XLogP | 3.3 |
|---|---|
| 극성 표면적 | 0 |
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 1 |
| 회전 가능 결합 수 | 0 |
| 무거운 원자 수 | 9 |
| 형식 전하 | 0 |
| 복잡도 | 99.1 |
| 끓는 점 | 96 °C |
| 밀도 | 2.008±0.06 g/cm3(Predicted) |
| 굴절률 | 1.601 |
| 인화점 | 96-98°C/15mm |
| 저장 조건 | Keep in dark place,Sealed in dry,Room Temperature |
| 물리적 상태 | 액체 |
| 색상 | Clear, colourless |
| BRN | 2435080 |
| InChI | 1S/C6H3ClFI/c7-5-3-4(8)1-2-6(5)9/h1-3H |
| InChIKey | POTCKVPDYXEGSV-UHFFFAOYSA-N |
| SMILES | Fc1ccc(I)c(Cl)c1 |
화학적 성질
Clear colourless to light yellow liquid
안전 및 규제
| GHS 분류 | DangerH301 (14.3%): Toxic if swallowed [Danger Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 7 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 3 (14.3%) |
| 수질 위해 등급(WGK) | WGK 3 |
| 관세 코드 | 2903998090 |
| 위험 문구(R) | 36/37/38-22-36 |
| 위험 표시 | Xi,Xn |
| 안전 문구(S) | 26-36/37/39-23 |
| 위험 등급 | IRRITANTAcute Tox. 3 OralEye Irrit. 2 |
| 저장 분류 | 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects |
용도
용도
2-Chloro-4-fluoroiodobenzene is a polyhalogenated benzene derivative containing reactive substituents such as fluorine, bromine and iodine atoms in its structure. It can be used as a raw material for the preparation of organic synthesis for the preparation of other organic heterocyclic compounds. It can also be used as a key intermediate component in the manufacture of pharmaceuticals.