플루오린화 사이안유릭(플루오르화 시안유릭)
시아누르풀르오르화물 · 플루오린화사이안유릭(플루오르화시안유릭) · 플루오린화사이안유릭(플루오르화시안유릭)(CYANURICFLUORIDE) · 2,4,6-TRIFLUORO-1,3,5-TRIAZINE · Trifluorotriazine · Cyanuric Flouride · NSC 168386 · CYANURIC FLUORIDE
식별자 및 물리적 특성
| CAS No. | 675-14-9 |
|---|---|
| 분자식 | C3F3N3 |
| 평균 분자량 | 135.05 g/mol |
| 단동위원소 질량 | 135.00443166 g/mol |
| SMILES | Fc1nc(F)nc(F)n1 |
| InChIKey | VMKJWLXVLHBJNK-UHFFFAOYSA-N |
| PubChem CID | 12664 |
| EC No. | 211-620-8 |
| DTXSID | DTXSID6060975 |
| 현지명 | 플루오린화 사이안유릭(플루오르화 시안유릭) |
화학 및 물리적 성질
| XLogP | 1.3 |
|---|---|
| 극성 표면적 | 38.7 |
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 6 |
| 회전 가능 결합 수 | 0 |
| 무거운 원자 수 | 9 |
| 형식 전하 | 0 |
| 복잡도 | 69.3 |
| 물질 분류 | Other Classes -> Other Organic Compounds |
| SpringerMaterials Properties | 15N nuclear magnetic resonance spectrum |
| 밀도 | 1.60 at 25 °C/4 °C1.60 @25 °C1,6 g/cm3 |
| Color/Form | Colorless |
| 끓는 점 | 72.8 °C72.4 °C @760 [mm Hg]73-74°C |
| 녹는점 | -38 °C-38°C |
| 굴절률 | Index of refraction: 1.3844 at 24 °C/D1.348 |
| Physical Description | Cyanuric fluoride is a liquid. (EPA, 1998)Colorless liquid[HSDB] |
| 인화점 | 73-74°C |
| 저장 조건 | Hygroscopic, Refrigerator, under inert atmosphere |
| 용해도 | 에 용해됨클로로포름, 사염화탄소, 에테르, 디옥산 및 케톤과 혼합 가능. |
| pKa(산도 계수) | -2.62±0.10(Predicted) |
| 물리적 상태 | 기름 |
| 색상 | 투명 무색 |
| BRN | 124237 |
| NIST | 1,3,5-Triazine, 2,4,6-trifluoro-(675-14-9) |
| EPA | Cyanuric fluoride (675-14-9) |
화학적 성질
Colorless liquid. Decompose violently with water and alcohol.
안전 및 규제
| GHS 분류 | DangerH310+H330 (16.7%): Fatal in contact with skin or if inhaled [Danger Acute toxicity, dermalacute toxicity, inhalation]P260, P262, P264, P264+P265, P270, P271, P280, P284, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P320, P321, P361+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| 규제 정보 | The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.) |
| 운송 라벨(DOT) | Poison Inhalation Hazard Corrosive |
| 화재 위험 | When heated to decomposition, it emits very toxic fumes of fluorides and nitrogen oxides. Avoid decomposing heat. (EPA, 1998) |
| 건강 유해성 | This material is highly toxic by skin contact and inhalation. (EPA, 1998) |
| 유해성 요약 | Cyanuric fluoride is irritating to the skin, eyes, and respiratory tract. Information is limited, but it is not known to cause cyanide poisoning. It is absorbed through the skin. When heated to decomposition, fumes of fluorides and oxides of nitrogen are formed. [HSDB] In high-dose inhalation studies, animals develop pulmonary edema. [ChemIDplus] |
| 반응성 그룹 | Amines, Phosphines, and Pyridines |
| Reactivity Alerts | Water-Reactive |
| Reactivity Profile | Cyanuric fluoride is used as a mild fluorinating agent for organic chemicals, and it reacts with water in a manner similar to an acyl halide, forming hydrofluoric acid and cyanuric acid. |
| Air and Water Reactions | No rapid reaction with air. No rapid reaction with water. |
| Highly Hazardous Substance | Chemical: Cyanuric Fluoride |
| CERCLA 보고 수량 | Releases of CERCLA hazardous substances are subject to the release reporting requirement of CERCLA section 103, codified at 40 CFR part 302, in addition to the requirements of 40 CFR part 355. Cyanuric fluoride is an extremely hazardous substance (EHS) subject to reporting requirements when stored in amounts in excess of its threshold planning quantity (TPQ) of 100 lbs. |
용도
용도
Cyanuric fluoride acts as a fluorinating agent used in the conversion of carboxylic acids into acyl fluorides. It is used as a precursor for fibre-reactive dyes. It is a specific reagent for tyrosine residues in enzyme. Further, it is involved in the preparation of cyanuric acid by hydrolysis
일반 설명
Liquid.
제조 및 합성 방법
제조 방법
In a dry three-necked flask equipped with stirrer, thermometer and reflux condenser, add 0.2mol (36.9g) of cyanuric chloride, 0.63mol (36.5g) of finely ground anhydrous potassium fluoride, 60mL of xylene and 2.0g of polyethylene glycol-600, heat and stir at 110℃, reflux for 16h and distill after a little cooling, collect the fraction at 72℃~75℃, and get liquid of cyanuric trioxide.