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HCID 12786Erstellt: 27. Oktober 2026
2,3,5,6-Tetrafluoranilin
2,3,5,6-TETRAFLUOROBENZENAMINE · Tetrafluoroaniline3 · Tetrafluorobenzenamine · 2,3,5,6-Tetrafluoraniline · 2,3,5,6-TETRAFLUOROANILINE · Aniline, 2,3,5,6-tetrafluoro- · 2,3,5,6-Tetrafluoroaniline98% · 2,3,5,6-Tetrafluoroaniline 98%
https://huagongshe.com/de/chemical/12786
Identifikatoren & physikalische Daten
| CAS No. | 700-17-4 |
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| Summenformel | C6H3F4N |
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| Durchschnittliche Molmasse | 165,09 g/mol |
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| Monoisotopische Masse | 165,02016198 g/mol |
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| SMILES | Nc1c(F)c(F)cc(F)c1F |
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| InChIKey | SPSWJTZNOXMMMV-UHFFFAOYSA-N |
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| PubChem CID | 12786 |
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| EC No. | 211-840-4 |
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| DTXSID | DTXSID30220259 |
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| Lokaler Name | 2,3,5,6-Tetrafluoranilin |
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Chemische & physikalische Eigenschaften
| XLogP | 1,7 |
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| Polarare Oberfläche (TPSA) | 26 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 11 |
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| Formalladung | 0 |
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| Komplexität | 129 |
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| Schmelzpunkt | 31-32 °C(lit.) |
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| Siedepunkt | 158 °C(lit.) |
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| Dichte | 1,744 g/cm3 |
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| Flammpunkt | 145 °F |
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| Lagerbedingungen | under inert gas (nitrogen or Argon) at 2–8 °C |
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| Löslichkeit | perchloric acid: soluble |
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| pKa (Säurekonstante) | -0.22±0.10(Predicted) |
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| Aggregatzustand | powder to lump to clear liquid |
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| Farbe | White or Colorless to Light orange to Yellow |
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| BRN | 2211579 |
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| InChI | InChI=1S/C6H3F4N/c7-2-1-3(8)5(10)6(11)4(2)9/h1H,11H2 |
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| InChIKey | SPSWJTZNOXMMMV-UHFFFAOYSA-N |
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| SMILES | C1(N)=C(F)C(F)=CC(F)=C1F |
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| CAS Datenbank | 700-17-4(CAS DataBase Reference) |
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| NIST chemische Informationen | 2,3,5,6-Tetrafluoroaniline(700-17-4) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (12.8%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 47 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Acute Tox. 4 (12.8%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| UN-Transportnummer | 2941 |
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| Zollcode | 29214200 |
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| R-Sätze (R) | 36/37/38-22 |
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| Gefahrensymbole | Xi,T,Xn |
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| hazard_note | Toxic |
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| Sicherheitshinweise (S) | 26-36/37/39-36 |
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| Gefahrenklasse | 6.1 |
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| Verpackungsgruppe | III |
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