HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 819062Erstellt: 27. Oktober 2026
6-Iodopyridine-3-carboxylic acid
6-Iodopyridine-3-carboxylic acid · 3-Pyridinecarboxylic acid, 6-iodo- · 6-iodopyridine-3-carboxylic acid - [K82252]
https://huagongshe.com/de/chemical/819062
Identifikatoren & physikalische Daten
| CAS No. | 13054-02-9 |
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| Summenformel | C6H4INO2 |
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| Durchschnittliche Molmasse | 249,01 g/mol |
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| Monoisotopische Masse | 248,92867637 g/mol |
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| SMILES | O=C(O)c1ccc(I)nc1 |
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| InChIKey | PCGJGRDGMJRQAJ-UHFFFAOYSA-N |
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| PubChem CID | 819062 |
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| EC No. | 897-619-9 |
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| DTXSID | DTXSID10356040 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,1 |
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| Polarare Oberfläche (TPSA) | 50,2 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 10 |
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| Formalladung | 0 |
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| Komplexität | 140 |
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| Schmelzpunkt | 189-190 °C(Solv: water (7732-18-5)) |
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| Siedepunkt | 355.2±27.0 °C(Predicted) |
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| Dichte | 2.123±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | 2-8°C |
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| Löslichkeit | DMSO (Slightly), Methanol (Slightly) |
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| Aggregatzustand | Solid |
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| pKa (Säurekonstante) | 3.29±0.10(Predicted) |
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| Farbe | Light Beige to Beige |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/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%) |
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| UN-Transportnummer | UN2811 |
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| Zollcode | 2933399990 |
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| Gefahrenklasse | 6.1 |
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