HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 735784Erstellt: 26. Oktober 2026
3-Chloro-5-(trifluoromethyl)benzene-1,2-diamine
BUTTPARK 75\04-15 · TIMTEC-BB SBB003446 · 3-Chloro-4,5-diaminobenzotrifluoride · 3-Chloro-4,5-diaminobenzotrifluoride98% · 3-Chloro-4,5-diaminobenzotrifluoride 98% · 3-Chloro-4,5-diaminobenzotrifluoride,97% · 3-chloro-5-trifluoromethylphenylenediamine · 3-chloro-5-(trifluoroMethyl)-2-aMino-aniline
https://huagongshe.com/de/chemical/735784
Identifikatoren & physikalische Daten
| CAS No. | 132915-80-1 |
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| Summenformel | C7H6ClF3N2 |
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| Durchschnittliche Molmasse | 210,58 g/mol |
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| Monoisotopische Masse | 210,01716053 g/mol |
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| SMILES | Nc1cc(C(F)(F)F)cc(Cl)c1N |
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| InChIKey | NVNLHLRVSHJKBN-UHFFFAOYSA-N |
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| PubChem CID | 735784 |
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| ChEBI | CHEBI:194656 |
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| EC No. | 670-924-2 |
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| DTXSID | DTXSID90352828 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,1 |
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| Polarare Oberfläche (TPSA) | 52 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 185 |
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| Schmelzpunkt | 42-43 °C |
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| Siedepunkt | 260.8±40.0 °C(Predicted) |
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| Dichte | 1.510±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | 2-8°C(protect from light) |
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| Aggregatzustand | solid |
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| pKa (Säurekonstante) | 1.88±0.10(Predicted) |
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| BRN | 4744598 |
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| InChI | 1S/C7H6ClF3N2/c8-4-1-3(7(9,10)11)2-5(12)6(4)13/h1-2H,12-13H2 |
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| InChIKey | NVNLHLRVSHJKBN-UHFFFAOYSA-N |
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| SMILES | Nc1cc(cc(Cl)c1N)C(F)(F)F |
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| CAS Datenbank | 132915-80-1(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (88.9%): Harmful if swallowed [Warning Acute toxicity, oral]P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 9 reports by companies from 4 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 (88.9%) |
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| Wassergefährdungsklasse (WGK) | WGK 3 |
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| UN-Transportnummer | 2811 |
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| Zollcode | 2921599090 |
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| R-Sätze (R) | 36/37/38-20/21/22-36-22 |
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| Gefahrensymbole | Xn,Xi |
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| hazard_note | Irritant |
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| Sicherheitshinweise (S) | 36/37/39-26 |
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| Gefahrenklasse | 6.1Acute Tox. 4 OralEye Irrit. 2 |
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| Verpackungsgruppe | III |
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| Lagerklasse | 11 - Combustible Solids |
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