基本情報
- CAS
26952-42-1- 標準SMILES
Nc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1[N+](=O)[O-]- InChIKey
IVOMCIOXYNVSEW-UHFFFAOYSA-N- 分子式
- C6H4N4O6
- 平均分子量
- 228.12 g/mol
- 単同位体質量
- 228.01308386
概要
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.
名称と識別子
- 優先名称
- 2,3,4-Trinitroaniline
- IUPAC
- 2,3,4-trinitroaniline
- 現地名
- トリニトロアニリン
- 英語名
- trinitroaniline
- 分子式
- C6H4N4O6
- 分子量
- 228.11916
名称と別名
TRINITROANILINE2,3,4-trinitroanilineDTXSID10949734EINECS 248-137-7RefChem:441744DTXCID201377915248-137-726952-42-1Benzenamine, trinitro-SCHEMBL304540SCHEMBL8024777IVOMCIOXYNVSEW-UHFFFAOYSA-N
名称をさらに表示
トリニトロアニリン
NS00052124
データベース識別子
- CAS
26952-42-1- PubChem CID
- 3032829
- DTXSID
DTXSID10949734- EC Number
- 248-137-7
物性
構造計算による物性
- XLogP
- 1.3
- 極性表面積
- 163 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 7
- 回転可能結合数
- 0
- 重原子数
- 16
- 形式電荷
- 0
- 複雑度
- 316
実験および物理化学的性質
Physical Description2,3,4-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.
物理化学的性質
- EPAの化学物質情報
- Trinitroaniline (26952-42-1)
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
危険有害性情報
DOT LabelExplosive 1.1D
Fire HazardsExcerpt from ERG Guide 112 [Explosives - Division 1.1, 1.2, 1.3 or 1.5]:
Health HazardsExcerpt from ERG Guide 112 [Explosives - Division 1.1, 1.2, 1.3 or 1.5]:
Reactive GroupNitro, Nitroso, Nitrate, and Nitrite Compounds, Organic
Reactivity AlertsExplosive
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 ReactionsFlammable/combustible material. May be ignited by heat, sparks or flames. DRIED OUT material may explode if exposed to heat, flame, friction or shock; Treat as an explosive.
DHS Chemicals of Interest (COI)
Trinitroaniline
A Commercial Grade
5000
A Commercial Grade
400
Explosive chemical that can be released at a facility.
安全と保護具
Fire FightingExcerpt from ERG Guide 112 [Explosives - Division 1.1, 1.2, 1.3 or 1.5]:
化学と産業
応用分野
一般的な説明An orange-red moist crystalline solid. Water slurry mitigates explosion hazard. Specific gravity 1.8. Melting point 370°F. Highly toxic.
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