基本情報
- 標準SMILES
CCN(Cc1ccc(Cl)nc1)C(=C[N+](=O)[O-])NC- InChIKey
CFRPSFYHXJZSBI-UHFFFAOYSA-N- 分子式
- C11H15ClN4O2
- 平均分子量
- 270.71 g/mol
- 単同位体質量
- 270.0883534
名称と識別子
- 優先名称
- N-((6-Chloro-3-pyridinyl)methyl)-N-ethyl-N'-methyl-2-nitro-1,1-ethenediamine
- IUPAC
- 1-N'-[(6-chloro-3-pyridinyl)methyl]-1-N'-ethyl-1-N-methyl-2-nitroethene-1,1-diamine
- 現地名
- ニテンピラム
- 英語名
- Nitenpyram
- 分子式
- C11H15ClN4O2
- 分子量
- 270.72
名称と別名
名称をさらに表示
データベース識別子
- CAS
120738-89-8- PubChem CID
- 86457
- DTXSID
DTXSID3058292- EC Number
- 601-735-5
物性
構造計算による物性
- XLogP
- 2.4
- 極性表面積
- 74 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 5
- 回転可能結合数
- 5
- 重原子数
- 18
- 形式電荷
- 0
- 複雑度
- 306
物理化学的性質
- 融点
- 83.5 °C · 83.5 °C
- 沸点
- 417.2 · 417.2±45.0 °C(Predicted)
- 比重(密度)
- 1.254 · 1.254±0.06 g/cm3(Predicted)
- 蒸気圧
- 1.1 x · 1.1 x 10-9 Pa (20 °C)
- 貯蔵温度
- -20 °C · Amber Vial, -20°C Freezer
- 溶解性
- DMSO(微量)、メタノール(微量)
- 酸解離定数(Pka)
- 3.1 · 3.1 (base), 11.5 (acid)
- 水溶解度
- 8.4 · 8.4×105 mg·l-1 (20℃、pH7)
- 外見
- 個体
- 色
- ライトイエロー~ライトオレンジ
- 安定性
- 光に敏感
- CAS データベース
- 120738 · 120738-89-8(CAS DataBase Reference)
安全と法規制
GHS分類
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 29 reports by companies from 2 notifications to the ECHA C&L Inventory.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Not Classified
危険有害性情報
Regulatory Information
1,1-Ethenediamine, N-[(6-chloro-3-pyridinyl)methyl]-N-ethyl-N'-methyl-2-nitro-: 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.
法規制情報
Regulatory Information
1,1-Ethenediamine, N-[(6-chloro-3-pyridinyl)methyl]-N-ethyl-N'-methyl-2-nitro-: 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.
安全データ
- ridadr
- 2588
- hs_code
- 29333990
- hazard_class
- 6.1(b)
- packing_group
- III
化学と産業
用途と製造
応用分野
使用Nitenpyram is used to control aphids, thrips, leafhoppers, whitefly and other sucking insects on rice and glasshouse crops.
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補足説明
定義ChEBI: A C-nitro compound consisting of 2-nitroethene-1,1-diamine where one of the nitrogens bears ethyl and (6-chloro-3-pyridinyl)methyl while the other nitrogen carries a methyl group.
関連反応
関連ノート
読み込み中…