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4,6-ジクロロ-N-(o-クロロフェニル)-1,3,5-トリアジン-2-アミン
ジレン50W · 4,6-ジクロロ-N-(o-クロロフェニル)-1,3,5-トリアジン-2-アミン · ジノクロル · アニヤリン · N-(2-クロロフェニル)-N-(2,4-ジクロロ-1,3,5-トリアジン-6-イル)アミン · 2,4-ジクロロ-6-[(2-クロロフェニル)アミノ]-1,3,5-トリアジン · ジクロロクロロアニロトリアジン · ボルトリサン
識別子と物理属性
| CAS No. | 101-05-3 |
|---|---|
| 分子式 | C9H5Cl3N4 |
| 平均分子量 | 275.5 g/mol |
| 単同位体質量 | 273.957979 g/mol |
| SMILES | Clc1nc(Cl)nc(Nc2ccccc2Cl)n1 |
| InChIKey | IMHBYKMAHXWHRP-UHFFFAOYSA-N |
| PubChem CID | 7541 |
| ChEMBL | CHEMBL464135 |
| ChEBI | CHEBI:82076 |
| EC No. | 202-910-5 |
| DTXSID | DTXSID9020089 |
| 現地名 | 4,6-ジクロロ-N-(o-クロロフェニル)-1,3,5-トリアジン-2-アミン |
化学・物理的性質
| XLogP | 3 |
|---|---|
| 極性表面積 | 50.7 |
| 水素結合供与体数 | 1 |
| 水素結合受容体数 | 4 |
| 回転可能結合数 | 2 |
| 重原子数 | 16 |
| 形式電荷 | 0 |
| 複雑度 | 221 |
| LogP（分配係数） | log Kow = 3.88 |
| 密度 | 1.8 at 68 °F (NTP, 1992) - Denser than waterwill sink1.8 @ 20 °C1.611 |
| Color/Form | White to tan crystals |
| 溶解度 | less than 1 mg/mL at 70 °F (NTP, 1992)SOL IN HYDROCARBON & MOST ORG SOLVENTS5 g/100 ml toluene, 4 g/100 ml xylene, and 10 g/100 ml acetone, each at 30 °CIn water, 8 mg/l @ 20 °C10mg/L(温度表記なし) |
| Corrosivity | Slightly corrosive to metals |
| Decomposition | DT50 (22 °C) 730 hr (pH 4), 790 hr (pH 7), 22 hr (pH 9)When heated to decomposition it emits very toxic fumes of /hydrogen chloride & nitrogen oxides/. |
| 融点 | 318 to 320 °F (NTP, 1992)159-160 °C159-160℃ |
| 蒸気圧 | Negligible (NTP, 1992)0.00000001 [mmHg]6.2X10-9 mm Hg @ 20 °C |
| Physical Description | Anilazine appears as white to tan crystals or white powder. Moderately soluble in organic solvents. Insoluble in water. Melting point 159 °C.White to tan solid[Merck Index] Colorless solid[MSDSonline] |
| Stability/Shelf Life | STABLE IN NEUTRAL & SLIGHTLY ACIDIC MEDIAHYDROLYZED BY ALKALI ON HEATING |
| Kovats Retention Index | 201019782009.12029.42009.52020.220372033.7 |
| Other Experimental Properties | Stable in neutral and slightly acidic media. Hydrolyzed on heating with alkalis. |
| 沸点 | 425.99°C (rough estimate) |
| 屈折率 | 1.6000 (estimate) |
| 貯蔵条件 | 0-6°C |
| pKa（酸解離定数） | 0.43±0.10(Predicted) |
| Merck | 13,659 |
| BRN | 223133 |
| ヘンリー定数 | 3.5×104 mol/(m3Pa) at 25℃, HSDB (2015) |
| 安定性 | 安定。オイル、アルカリとは相溶しません。特定の種類の金属や合金を腐食する可能性があります。 |
| 主な用途 | 農業環境 |
| InChI | 1S/C9H5Cl3N4/c10-5-3-1-2-4-6(5)13-9-15-7(11)14-8(12)16-9/h1-4H,(H,13,14,15,16) |
| InChIKey | IMHBYKMAHXWHRP-UHFFFAOYSA-N |
| SMILES | Clc1nc(Cl)nc(Nc2ccccc2Cl)n1 |
| CAS データベース | 101-05-3(CAS DataBase Reference) |
| EPAの化学物質情報 | Anilazine (101-05-3) |
化学的特性
white to light brown crystals or powder
安全性と法規制
| GHS 分類 | WarningH315: Causes skin irritation [Warning Skin corrosion/irritation]H319: Causes serious eye irritation [Warning Serious eye damage/eye irritation]H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]H410: Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)Danger |
|---|---|
| 規制情報 | 2002/20761,3,5-Triazin-2-amine, 4,6-dichloro-N-(2-chlorophenyl)-: 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.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.) |
| その他の安全情報 | IMAP assessments - 1,3,5-Triazin-2-amine, 4,6-dichloro-N-(2-chlorophenyl)-: Environment tier I assessmentIMAP assessments - 1,3,5-Triazin-2-amine, 4,6-dichloro-N-(2-chlorophenyl)-: Human health tier I assessment |
| 輸送ラベル（DOT） | Class 9 |
| 火災危険 | Flash point data for this chemical are not availablehowever, it is probably combustible. (NTP, 1992) |
| 健康有害性 | SYMPTOMS: Symptoms of exposure to this compound may include irritation of the gastrointestinal tract and the respiratory tract. Severe eye irritation may occur. Prolonged skin contact may cause irritation.ACUTE/CHRONIC HAZARDS: This compound is a severe eye irritant. Prolonged skin contact may cause irritation. When heated to decomposition it emits toxic fumes of chlorine and nitrogen oxides. (NTP, 1992) |
| 有害性の概要 | A skin and eye irritant[HSDB] A severe eye irritant[CAMEO] A skin and eye irritant[eChemPortal: ESIS] Very toxic to aquatic organismsEvidence of skin sensitization in guinea pig testsPositive patch tests were reported in 6 pickers in tomato fields who developed dermatitis |
用途
用途
失効農薬、抗真菌薬、窒素複素環系殺菌剤
使用
Pesticide used to control fungus diseases in lawns and turf.
一般的な説明
White to tan crystals or white powder. Moderately soluble in organic solvents. Insoluble in water. Melting point 159°C.