Triflumuron (HCID 47445)

名称と識別子

優先名称: Triflumuron
IUPAC: 2-chloro-N-[[4-(trifluoromethoxy)phenyl]carbamoyl]benzamide
現地名: 1-(2-クロロベンゾイル)-3-(4-トリフルオロメトキシフェニル)尿素
英語名: Triflumuron
分子式: C15H10ClF3N2O3
分子量: 358.7

名称と別名

Triflumuron64628-44-0TrifluronSIR 8514DTXSID50343552-Chloro-N-(((4-(trifluoromethoxy)phenyl)amino)carbonyl)benzamide3FT64DYG8K2-chloro-N-[[4-(trifluoromethoxy)phenyl]carbamoyl]benzamide1-(o-chlorobenzoyl)-3-(p-(trifluoromethoxy)phenyl)urea2-chloro-N-((4-(trifluoromethoxy)phenyl)carbamoyl)benzamideDTXCID3014355CHEBI:39388

名称をさらに表示

トリフルロン1-(2-クロロベンゾイル)-3-(4-トリフルオロメトキシフェニル)尿素アルシスチントリフルムロンフルカルベンズロントリフルムロン標準品トリフルムロン STANDARDトリフルムロン Standard, 100 µg/mL in Methanol1-(2-クロロベンゾイル)-3-[4-(トリフルオロメトキシ)フェニル]尿素MascotOMS 2015BAYSIRAlystinsir8514BAY-8514BAYCIDALALSYSTINSTARYCIDE

2-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide2-chloro-N-({[4-(trifluoromethoxy)phenyl]amino}carbonyl)benzamideBAY SIR 8514BAY-Sir-8514RefChem:1915681-(4-trifluoromethoxyphenyl)-3-(2-chlorobenzoyl)urea2-chloro-N-(4-(trifluoromethoxy)phenylaminocarbonyl)benzamide2-chloro-N-((((4-trifluoromethoxy)phenyl)amino)carbonyl)benzamide

データベース識別子

CAS: 64628-44-0
PubChem CID: 47445
DTXSID: DTXSID5034355
ChEMBL: CHEMBL1394379
ChEBI: CHEBI:39388
UNII: 3FT64DYG8K
EC Number: 264-980-3
Nikkaji: J20.690C

物性

構造計算による物性

XLogP: 5.6
極性表面積: 67.4 Å²
水素結合供与体数: 2
水素結合受容体数: 6
回転可能結合数: 3
重原子数: 24
形式電荷: 0
複雑度: 454

実験および物理化学的性質

Collision Cross Section · 2 件

179.1 Å² [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID5034355]；186.6 Å² [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID5034355]

169.88 Å² [M+H]+ [CCS Type: TW]

物理化学的性質

融点: 198 ℃ · 198℃
比重(密度): 1.475 · 1.475±0.06 g/cm3(Predicted)
蒸気圧: 0 Pa · 0Pa at 20℃
貯蔵温度: 0 · 0-6°C
溶解性: DMFに可溶
酸解離定数(Pka): 9.79 · 9.79±0.46(Predicted)
外見: Solid
色: White to off-white
水溶解度: 40 μg/L · 40μg/L at 20℃
BRN: 2776684 · 2776684
Henry's Law Constant: 1.1 · 1.1×103 mol/(m3Pa) at 25℃, Ebert et al. (2023)
主な用途: 農業環境
InChI: 1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)
InChIKey: XAIPTRIXGHTTNT-UHFFFAOYSA-N
SMILES: FC(F)(F)Oc1ccc(NC(=O)NC(=O)c2ccccc2Cl)cc1
LogP: 4.68 at · 4.68 at 25℃
CAS データベース: 64628 · 64628-44-0(CAS DataBase Reference)
EPAの化学物質情報: Triflumuron (64628-44-0)

化学的性質

化学的特性White Solid

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H330 (56.5%): Fatal if inhaled [Danger Acute toxicity, inhalation]；H400 (43.5%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (43.5%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P260, P271, P273, P284, P304+P340, P316, P320, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 69 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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.

危険有害性情報

Regulatory Information · 4 件

Commission Regulation (EC) No 33/2008

2011/23/EU, Reg. (EU) 2022/801, Reg. (EU) No 540/2011

Status: Active Update: 09-11-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/33074

Triflumuron: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Benzamide, 2-chloro-N-[[[4-(trifluoromethoxy)phenyl]amino]carbonyl]-: Environment tier I assessment；IMAP assessments - Benzamide, 2-chloro-N-[[[4-(trifluoromethoxy)phenyl]amino]carbonyl]-: Human health tier I assessment

Hazard Classes and CategoriesAcute Tox. 2 (56.5%)；Aquatic Acute 1 (43.5%)；Aquatic Chronic 1 (43.5%)

法規制情報

Regulatory Information · 4 件

Commission Regulation (EC) No 33/2008

2011/23/EU, Reg. (EU) 2022/801, Reg. (EU) No 540/2011

Status: Active Update: 09-11-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/33074

Triflumuron: Does not have an individual approval but may be used under an appropriate group standard

安全データ

wgk: 2
rtecs: CV2474000
毒性: LD50 in rats, mice (mg/kg): >5000, >5000 i.p., s.c., orally (Zoebelein)
safety_code: 22-24/25
Hazard Classifications: Acute Tox. 2 Inhalation
ストレージクラス: 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials

化学と産業

薬理情報

MeSH Pharmacological Classification · 2 件

Compounds that cause reproductive sterility in organisms. They are sometimes used to control pest populations by sterilizing males within the population.

Pesticides designed to control insects that are harmful to man. The insects may be directly harmful, as those acting as disease vectors, or indirectly harmful, as destroyers of crops, food products, or textile fabrics.

応用分野

説明Triflumuron, a benzoylphenyl urea compound, is an insect development inhibitor that inhibits the synthesis of chitin. It is formulated as an off-shears pour-on lousicide for control of the sheep body louse Bovicola ovis.

使用Triflumuron is a benzoylphenylurea insecticide. Triflumuron is a chitin synthesis inhibitor used to control insects pests such as mosquitos and flies.

上流・下流製品情報

上流原料

4-(トリフルオロメトキシ)アニリン 2-Chlorobenzoyl isocyanate 水素フッ化水素酸 1-(2-クロロベンゾイル)-3-(4-クロロベンゾイル)尿素

サプライヤー50 社

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

艾吉析科技（上海）有限公司17717235263 · [email protected]

广州佳途科技股份有限公司81960175 18933936954 · [email protected]

杭州品高化工有限公司0571-87658025 · [email protected]

上海腾准生物科技有限公司19821570922 · [email protected]

1-(2-クロロベンゾイル)-3-(4-トリフルオロメトキシフェニル)尿素

基本情報