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HCID 604813Erstellt: 2. November 2026
Ethyl 2,4-dichloro-6-methylnicotinate
AURORA KA-4546 · BUTTPARK 43\57-69 · ETHYL 2,4-DICHLORO-6-METHYLNICOTINATE · 2,4-Dichloro-6-methyl-nicotinic acid ethyl ester · Ethyl 2,4-dichloro-6-methyloyridine-3-carboxylate · Ethyl 2,4-dichloro-6-methyl-3-pyridinecarboxylate · Ethyl 2,4-dichloro-6-methylpyridine-3-carboxylate · 2,4-dichloro-5-ethyl-6-methyl-3-pyridinecarboxylate
https://huagongshe.com/de/chemical/604813
Identifikatoren & physikalische Daten
| CAS No. | 86129-63-7 |
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| Summenformel | C9H9Cl2NO2 |
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| Durchschnittliche Molmasse | 234,08 g/mol |
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| Monoisotopische Masse | 233,0010339 g/mol |
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| SMILES | CCOC(=O)c1c(Cl)cc(C)nc1Cl |
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| InChIKey | ZNFJVVLTQSOWJY-UHFFFAOYSA-N |
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| PubChem CID | 604813 |
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| EC No. | 672-871-0 |
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| DTXSID | DTXSID60345489 |
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Chemische & physikalische Eigenschaften
| XLogP | 3,1 |
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| Polarare Oberfläche (TPSA) | 39,2 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 3 |
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| Schwere Atome | 14 |
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| Formalladung | 0 |
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| Komplexität | 213 |
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| Schmelzpunkt | 53 °C |
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| Siedepunkt | 113-116 °C |
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| Dichte | 1.320±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | under inert gas (nitrogen or Argon) at 2-8°C |
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| Aggregatzustand | solid |
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| pKa (Säurekonstante) | -0.22±0.10(Predicted) |
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| Farbe | Light brown |
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| InChI | InChI=1S/C9H9Cl2NO2/c1-3-14-9(13)7-6(10)4-5(2)12-8(7)11/h4H,3H2,1-2H3 |
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| InChIKey | ZNFJVVLTQSOWJY-UHFFFAOYSA-N |
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| SMILES | C1(Cl)=NC(C)=CC(Cl)=C1C(OCC)=O |
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| CAS Datenbank | 86129-63-7(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%)Eye Irrit. 2 (100%)STOT SE 3 (100%) |
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| Zollcode | 2933399990 |
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| R-Sätze (R) | 36/37/38 |
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| Gefahrensymbole | Xi |
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| Sicherheitshinweise (S) | 26-36/37/39-37/39 |
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| Gefahrenklasse | IRRITANT |
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