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HCID 9480Erstellt: 27. Oktober 2026
α,α,α,α',α',α'-Hexafluor-3,5-xylidin
3,5-DI(TRIFLUOROMETHYL)ANILINE · MBT-NH2 · 3,5-Bis(Trifluoro · AKOS BBS-00003710 · TIMTEC-BB SBB000690 · 3,5-Di(trifluorometh · 3,5-difluoromethylaniline · 3,5-Bis(trifluormethyl)aniline
https://huagongshe.com/de/chemical/9480
Identifikatoren & physikalische Daten
| CAS No. | 328-74-5 |
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| Summenformel | C8H5F6N |
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| Durchschnittliche Molmasse | 229,12 g/mol |
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| Monoisotopische Masse | 229,03261848 g/mol |
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| SMILES | Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 |
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| InChIKey | CDIDGWDGQGVCIB-UHFFFAOYSA-N |
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| PubChem CID | 9480 |
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| EC No. | 206-335-0 |
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| DTXSID | DTXSID1059814 |
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| Lokaler Name | α,α,α,α',α',α'-Hexafluor-3,5-xylidin |
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Chemische & physikalische Eigenschaften
| XLogP | 3,6 |
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| Polarare Oberfläche (TPSA) | 26 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 7 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 15 |
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| Formalladung | 0 |
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| Komplexität | 198 |
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| LogP (Verteilungskoeffizient) | 3.57 |
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| Schmelzpunkt | 168.2-169.2 °C |
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| Siedepunkt | 85 °C15 mm Hg(lit.) |
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| Dichte | 1.467 g/mL at 25 °C(lit.) |
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| Brechungsindex | n20/D 1.434(lit.) |
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| Flammpunkt | 182 °F |
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| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
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| Aggregatzustand | Liquid |
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| pKa (Säurekonstante) | 2.15±0.10(Predicted) |
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| Wichte | 1.473 |
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| Farbe | Clear light yellow to yellow-brown |
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| Löslichkeit | Not miscible in water. |
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| BRN | 654318 |
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| InChI | 1S/C8H5F6N/c9-7(10,11)4-1-5(8(12,13)14)3-6(15)2-4/h1-3H,15H2 |
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| InChIKey | CDIDGWDGQGVCIB-UHFFFAOYSA-N |
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| SMILES | Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F |
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| CAS Datenbank | 328-74-5(CAS DataBase Reference) |
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| NIST chemische Informationen | Benzenamine, 3,5-bis(trifluoromethyl)-(328-74-5) |
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| EPA chemische Informationen | Benzenamine, 3,5-bis(trifluoromethyl)- (328-74-5) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (15.1%): Harmful if swallowed [Warning Acute toxicity, oral]P260, 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 53 reports by companies from 13 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 (15.1%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| TSCA-Inventar-Status | TSCA listed |
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| UN-Transportnummer | 2810 |
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| Zollcode | 29214910 |
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| RTECS-Nr. | ZE9800000 |
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| R-Sätze (R) | 33-36/37/38-20/21/22 |
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| Gefahrensymbole | Xi,Xn |
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| hazard_note | Irritant |
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| Sicherheitshinweise (S) | 26-36/37/39-36 |
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| Gefahrenklasse | 6.1Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
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| Verpackungsgruppe | III |
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| Lagerklasse | 10 - Combustible liquids |
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