Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
트리니트로아닐린
트리니트로아닐린 · trinitroaniline
식별자 및 물리적 특성
| CAS No. | 26952-42-1 |
|---|---|
| 분자식 | C6H4N4O6 |
| 평균 분자량 | 228.12 g/mol |
| 단동위원소 질량 | 228.01308386 g/mol |
| SMILES | Nc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1[N+](=O)[O-] |
| InChIKey | IVOMCIOXYNVSEW-UHFFFAOYSA-N |
| PubChem CID | 3032829 |
| EC No. | 248-137-7 |
| DTXSID | DTXSID10949734 |
| 현지명 | 트리니트로아닐린 |
화학 및 물리적 성질
| XLogP | 1.3 |
|---|---|
| 극성 표면적 | 163 |
| 수소 결합 공여자 수 | 1 |
| 수소 결합 수용자 수 | 7 |
| 회전 가능 결합 수 | 0 |
| 무거운 원자 수 | 16 |
| 형식 전하 | 0 |
| 복잡도 | 316 |
| Physical Description | 2,3,4-trinitroaniline appears as an orange-red crystalline structure. Highly toxic. May explode under exposure to heat or fire. Primary hazard is blast of an instantaneous explosion, not flying projectiles or fragments. |
| EPA | Trinitroaniline (26952-42-1) |
안전 및 규제
| 운송 라벨(DOT) | Explosive 1.1D |
|---|---|
| 화재 위험 | Excerpt from ERG Guide 112 [Explosives - Division 1.1, 1.2, 1.3 or 1.5]: |
| 건강 유해성 | Excerpt from ERG Guide 112 [Explosives - Division 1.1, 1.2, 1.3 or 1.5]: |
| 반응성 그룹 | Nitro, Nitroso, Nitrate, and Nitrite Compounds, Organic |
| Reactivity Alerts | Explosive |
| Reactivity Profile | 2,3,4-TRINITROANILINE is a nitrated aromatic amine. Materials in this group range from slight to strong oxidizing agents. If mixed with reducing agents, including hydrides, sulfides and nitrides, they may begin a vigorous reaction that culminates in a detonation. The aromatic nitro compounds may explode in the presence of a base such as sodium hydroxide or potassium hydroxide even in the presence of water or organic solvents. The explosive tendencies of aromatic nitro compounds are increased by the presence of multiple nitro groups. |
| Air and Water Reactions | Flammable/combustible material. May be ignited by heat, sparks or flames. DRIED OUT material may explode if exposed to heat, flame, friction or shockTreat as an explosive. |
| DHS Chemicals of Interest (COI) | TrinitroanilineA Commercial Grade5000400Explosive chemical that can be released at a facility. |
| 소화 | Excerpt from ERG Guide 112 [Explosives - Division 1.1, 1.2, 1.3 or 1.5]: |
| 응급 처치 | Excerpt from ERG Guide 112 [Explosives - Division 1.1, 1.2, 1.3 or 1.5]: |
| 비화재 누출 대응 | Excerpt from ERG Guide 112 [Explosives - Division 1.1, 1.2, 1.3 or 1.5]: |
| Isolation and Evacuation | Excerpt from ERG Guide 112 [Explosives - Division 1.1, 1.2, 1.3 or 1.5]: |
| Personal Protective Equipment (PPE) | Excerpt from ERG Guide 112 [Explosives - Division 1.1, 1.2, 1.3 or 1.5]: |
| 운송 번호(UN) | UN 0153 (TRINITROANILINE (PICRAMIDE)) |
용도
일반 설명
An orange-red moist crystalline solid. Water slurry mitigates explosion hazard. Specific gravity 1.8. Melting point 370°F. Highly toxic.