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2-クロロ-6-(トリクロロメチル)ピリジン
N-サーブ · 2-クロロ-6-(トリクロロメチル)ピリジン · N-サーブ窒素スタビライザ · クロロトリクロロメチルピリジン · ニトラピリン · ニトラピリン標準品 · 2-クロロ-6-トリクロロメチルピリジン · 2‐クロロ‐6‐トリクロロメチルピリジン (別名 ニトラピリン)
識別子と物理属性
| CAS No. | 1929-82-4 |
|---|---|
| 分子式 | C6H3Cl4N |
| 平均分子量 | 230.9 g/mol |
| 単同位体質量 | 228.90196 g/mol |
| SMILES | Clc1cccc(C(Cl)(Cl)Cl)n1 |
| InChIKey | DCUJJWWUNKIJPH-UHFFFAOYSA-N |
| PubChem CID | 16004 |
| ChEMBL | CHEMBL1557091 |
| ChEBI | CHEBI:81935 |
| EC No. | 217-682-2 |
| DTXSID | DTXSID0024216 |
| 現地名 | 2-クロロ-6-(トリクロロメチル)ピリジン |
化学・物理的性質
| XLogP | 3.4 |
|---|---|
| 極性表面積 | 12.9 |
| 水素結合供与体数 | 0 |
| 水素結合受容体数 | 1 |
| 回転可能結合数 | 0 |
| 重原子数 | 11 |
| 形式電荷 | 0 |
| 複雑度 | 133 |
| LogP（分配係数） | 3.4 |
| 密度 | Relative density of the vapour/air-mixture at 20 °C (air = 1): 1.01.8732 (rough estimate) |
| 溶解度 | less than 0.1 mg/mL at 64 °F (NTP, 1992)Solubility in water: noneInsoluble10 mg/ml エタノールに可溶。不溶性。 <0.01 g/100 mL で 18 ºC |
| 引火点 | 100 °C c.c. |
| 沸点 | 277 to 280 °F at 11 mmHg (NTP, 1992)at 1.5kPa: 136 °C277 to 280 °F at 11 mmHg136-138°C |
| 融点 | 144.5 to 145.2 °F (NTP, 1992)63 °C145 °F62-63°C |
| 蒸気圧 | 0.0028 mmHg at 73 °F (NTP, 1992)0.0048 [mmHg]Vapor pressure, Pa at 23 °C:0.003 mmHg at 73 °F0.003 [mm Hg] @22.5 °C(73 °F): 0.003 mmHg2.8 x 10-3 mmHg at 20 °C (quoted, Verschueren, 1983) |
| Physical Description | Nitrapyrin appears as colorless crystals or off-white crystalline solid. (NTP, 1992)LiquidColorless or white, crystalline solid with a mild, sweet odor[NIOSH]COLOURLESS-TO-WHITE CRYSTALS WITH CHARACTERISTIC ODOUR.Colorless or white, crystalline solid with a mild, sweet odor. |
| Kovats Retention Index | 1463.6 |
| 屈折率 | 1.6000 (estimate) |
| 貯蔵条件 | Keep in dark place,Sealed in dry,Room Temperature |
| 外観・状態 | 粉 |
| pKa（酸解離定数） | -3.75±0.10(Predicted) |
| 色 | 白い |
| 比重 | 1.579 (25℃) |
| Merck | 14,6574 |
| BRN | 1618997 |
| ヘンリー定数 | 2.13 x 10-3 atmm3/mol (approximate - calculated from water solubility and vapor pressure) |
| 主な用途 | 農業環境 |
| InChI | 1S/C6H3Cl4N/c7-5-3-1-2-4(11-5)6(8,9)10/h1-3H |
| InChIKey | DCUJJWWUNKIJPH-UHFFFAOYSA-N |
| SMILES | Clc1cccc(n1)C(Cl)(Cl)Cl |
| LogP（分配係数） | 3.325-3.41 at 23.5℃ |
| CAS データベース | 1929-82-4(CAS DataBase Reference) |
| NISTの化学物質情報 | Pyridine, 2-chloro-6-(trichloromethyl)-(1929-82-4) |
| EPAの化学物質情報 | Nitrapyrin (1929-82-4) |
化学的特性
Crystals.
安全性と法規制
| GHS 分類 | WarningH302: Harmful if swallowed [Warning Acute toxicity, oral]H411: Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement) |
|---|---|
| 規制情報 | Chemical: Pyridine, 2-chloro-6-(trichloromethyl)-Specific Information Requirement: Obligations to provide information apply. These obligations are:1. A person introducing this chemical must tell us in writing within 28 calendar days if any of the following circumstances have occurred in relation to their introduction (importation or manufacture):a. residues of the chemical are detected in food producing cropsb. products containing the chemical are intended to be used by members of the publicc. products containing the chemical are intended to be used in domestic settingsd. the chemical is imported in solid forme. additional information becomes available that suggests residues of the chemical and/or its metabolites are detected in crops treated with the chemical as microcapsulesf. products containing the chemical are intended to be applied by equipment other than low ground boom.2. A person who introduces this chemical must tell us in writing within 28 calendar days if they become aware of any of the following circumstances, namely, that since the assessment under the Industrial Chemicals (Notification and Assessment) Act 1989:a. the function or use of the chemical has changed, or is likely to change, significantlyb. the amount of the chemical being introduced has increased, or is likely to increase, significantlyc. in the case of a chemical not manufactured, or proposed to be manufactured, in Australia at the time of the assessmentâit has begun to be manufactured in Australiad. the method of manufacture of the chemical in Australia has changed, or is likely to change, in a way that may result in an increased risk of an adverse effect of the chemical on occupational health and safety, public health or the environmente. additional information has become available to the person as to an adverse effect of the chemical on occupational health and safety, public health or the environment.Hazard Traits - CarcinogenicityDevelopmental ToxicityAuthoritative List - Prop 65 |
用途
用途
ニトラピリン試験用標準品。
用途
農薬、抗菌剤、硝化阻害剤
使用
Fertilizer additive to control nitrification and prevent loss of soil nitrogen.
一般的な説明
Colorless crystals or off-white crystalline solid.