Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
에토펜프록스
2-(4-에톡시페닐)-2-메틸프로필=3-페녹시벤질에테르 · 에토펜프록스 · ETHOFENPROX · PEPE · 1-((2-(4-ethoxyphenyl)-2-methylpropoxy)methyl)-3-phenoxybenzene · NUKIL · TREBON · mti500
식별자 및 물리적 특성
| CAS No. | 1705649-55-3 |
|---|---|
| 분자식 | C25H28O3 |
| 평균 분자량 | 376.5 g/mol |
| 단동위원소 질량 | 376.20384476 g/mol |
| SMILES | CCOc1ccc(C(C)(C)COCc2cccc(Oc3ccccc3)c2)cc1 |
| InChIKey | YREQHYQNNWYQCJ-UHFFFAOYSA-N |
| PubChem CID | 71245 |
| ChEMBL | CHEMBL2105573 |
| ChEBI | CHEBI:39348 |
| EC No. | 109-904-0 |
| DTXSID | DTXSID9032610 |
| 현지명 | 에토펜프록스 |
화학 및 물리적 성질
| XLogP | 7 |
|---|---|
| 극성 표면적 | 27.7 |
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 3 |
| 회전 가능 결합 수 | 9 |
| 무거운 원자 수 | 28 |
| 형식 전하 | 0 |
| 복잡도 | 422 |
| 농약 | Agrochemicals -> Pesticide active substancesActive substance -> EU Pesticides database: ApprovedEnvironmental transformation -> Pesticides (parent, predecessor)InsecticidesPesticide (Etofenprox) -> USDA PDB |
| LogP(분배 계수) | 7.05 |
| Endocrine Disruptors | Potential endocrine disrupting compound |
| Collision Cross Section | 191.0 Ų [M+Na]+ [CCS Type: DTBuffer gas: N2Ionization: ESI+Dataset: TOXCASTSource Identifier: DTXSID9032610]191.81 Ų [M+Na]+189.38 Ų [M]+ [CCS Type: TWIonization: GC-APCI+] |
| 녹는점 | 36.4-38.0° |
| 끓는 점 | 445.03°C (rough estimate) |
| 밀도 | 1.1386 (rough estimate) |
| 증기압 | 32×10-3 Pa (100 °C) |
| 굴절률 | nD20.2 1.5732 |
| 저장 조건 | Sealed in dry,Room Temperature |
| 용해도 | DMSO: 100 mg/mL (265.61 mM) |
| 물리적 상태 | Solid |
| 용해도 | -1(25°C) |
| 색상 | Off-white to light yellow |
| 헨리 상수 | 7.4×101 mol/(m3Pa) at 25℃, Maniere et al. (2011) |
| 안정성 | 안정적인. 강한 산화제와 호환되지 않습니다. |
| 주요 응용 | 농업환경 |
| InChI | 1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3 |
| InChIKey | YREQHYQNNWYQCJ-UHFFFAOYSA-N |
| SMILES | CCOc1ccc(cc1)C(C)(C)COCc2cccc(Oc3ccccc3)c2 |
| NIST | Etofenprox(80844-07-1) |
| EPA | Etofenprox (80844-07-1) |
화학적 성질
solid
안전 및 규제
| GHS 분류 | WarningH362: May cause harm to breast-fed children [Reproductive toxicity, effects on or via lactation]P203, P260, P263, P264, P270, P273, P318, P391, and P501 (click each P-code to see the statement)H362 (96.7%): May cause harm to breast-fed children [Reproductive toxicity, effects on or via lactation] |
|---|---|
| 규제 정보 | Commission Regulation (EC) No 1490/2002Etofenprox is listed in the dataset of EPA Human Health Benchmarks for Pesticides under the Safe Drinking Water Act (40 eCFR 141)2009/77/EC, Reg. (EU) 2021/1449, Reg. (EU) 2022/1480, Reg. (EU) 2023/2592, Reg. (EU) No 540/2011Status: Cease Manufacture Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/4043Etofenprox: HSNO Approval: HSR003567 Approved with controls |
| Hazard Classes and Categories | Lact. (75%)Lact. (96.7%)Lact. (100%)Reproductive toxicity - effects on or via lactationHazardous to the aquatic environment (Acute) - Category 1Specific target organ toxicity - Single exposure - Category 1 (central nervous system), Category 3 (narcotic effects) |
| RAIS Toxicity Values | 0.0255OPP |
| EPA Human Health Benchmarks for Pesticides | Etofenprox0.0255151General PopulationHuman Health Benchmarks for Pesticides - 2021 Update |
| 수질 위해 등급(WGK) | 2 |
| RTECS 번호 | DA0670000 |
| 운송 번호(UN) | UN 3077 9 / PGIII |
| 독성 | LD50 in rats, mice (mg/kg): >2880, >107200 orally>2140, >2140 dermally |
| 기존화학 물질 | KE-13473 |
| 위험 등급 | Aquatic Acute 1Aquatic Chronic 1Lact. |
| 저장 분류 | 11 - Combustible Solids |
용도
용도
Etofenprox is used to control a wide variety of insects on fruit, tea, soyabeans and many vegetables. It is also used in public health and animal health.