HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 27295Erstellt: 27. Oktober 2026
Fluordifen
Flurodifen · Soyex · C 6989 · C 6929 · Preferan · Preforan · NSC 58415 · Fluordifen
https://huagongshe.com/de/chemical/27295
Identifikatoren & physikalische Daten
| CAS No. | 15457-05-3 |
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| Summenformel | C13H7F3N2O5 |
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| Durchschnittliche Molmasse | 328,2 g/mol |
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| Monoisotopische Masse | 328,03070598 g/mol |
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| SMILES | O=[N+]([O-])c1ccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 |
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| InChIKey | HHMCAJWVGYGUEF-UHFFFAOYSA-N |
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| PubChem CID | 27295 |
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| ChEMBL | CHEMBL1892429 |
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| ChEBI | CHEBI:5116 |
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| EC No. | 239-474-0 |
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| DTXSID | DTXSID7037553 |
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| Lokaler Name | Fluordifen |
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Chemische & physikalische Eigenschaften
| XLogP | 3,7 |
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| Polarare Oberfläche (TPSA) | 101 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 8 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 23 |
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| Formalladung | 0 |
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| Komplexität | 440 |
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| SpringerMaterials Properties | Fusion temperature |
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| Pestizide | HerbicidesActive substance -> EU Pesticides database: Not approvedPesticide (Fluorodifen) -> USDA PDB |
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| LogP (Verteilungskoeffizient) | 3.7 |
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| Collision Cross Section | 162.6 Ų [M-H]- [CCS Type: DTBuffer gas: N2Ionization: ESI-Dataset: TOXCASTSource Identifier: DTXSID7037553] |
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| Schmelzpunkt | 94℃ |
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| Siedepunkt | 371.1±42.0 °C(Predicted) |
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| Dichte | 1.5601 (estimate) |
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| Löslichkeit | Chloroform (Slightly), Methanol (Slightly)2mg/L(20 ºC) |
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| Farbe | Yellowish-brown crystals |
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| BRN | 2018474 |
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| Henry-Konstante | 6.5×102 mol/(m3Pa) at 25℃, MacBean (2012) |
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| Hauptanwendungen | agricultureenvironmental |
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| InChI | 1S/C13H7F3N2O5/c14-13(15,16)8-1-6-12(11(7-8)18(21)22)23-10-4-2-9(3-5-10)17(19)20/h1-7H |
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| InChIKey | HHMCAJWVGYGUEF-UHFFFAOYSA-N |
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| SMILES | [O-][N+](=O)c1ccc(Oc2ccc(cc2[N+]([O-])=O)C(F)(F)F)cc1 |
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| EPA chemische Informationen | Fluorodifen (15457-05-3) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH319 (92.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]P261, P264+P265, P271, P273, P280, P304+P340, P305+P351+P338, P317, P337+P317, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 42 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatorische Informationen | 2002/2076 |
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| Hazard Classes and Categories | Eye Irrit. 2 (92.9%) |
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| Acute Toxicity Link | Chemical: FLUORODIFEN |
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| Wassergefährdungsklasse (WGK) | 2 |
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| TSCA-Inventar-Status | TSCA listed |
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| UN-Transportnummer | UN3077 9/PG 3 |
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| RTECS-Nr. | KO2750000 |
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| R-Sätze (R) | 36-50/53 |
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| Toxizität | LD50 orl-rat: 9000 mg/kg FMCHA2 -,C194,83 |
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| Gefahrensymbole | Xi,N |
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| Sicherheitshinweise (S) | 26-60-61 |
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| Lagerklasse | 11 - Combustible Solids |
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| Gefahrenklasse | Acute Tox. 4 InhalationAquatic Acute 1Eye Irrit. 2 |
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