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4-Chloro-1H-imidazo[4,5-c]pyridine
4-CHLORO-1-H-IMIDAZO[4 · 4-Chloro-1-H-imidazo[4,5-c]pyridine · 3H-IMidazo[4,5-c]pyridine, 4-chloro- · 4-Chloro-1H-imidazo[4,5-c]pyridine 98% · 4-CHLORO-1-H-IMIDAZO[4,5-C]PYRIDINE ISO 9001：2015 REACH · 4-CHLORO-1-H-IMIDAZO[4,5-C]PYRIDINE4-CHLORO-1-H-IMIDAZO[4,5-C]PYRIDINE
![Molekülstruktur von 4-Chloro-1H-imidazo[4,5-c]pyridine](/img/chemical/5373364.png)
Identifikatoren & physikalische Daten
| CAS No. | 2770-01-6 |
|---|---|
| Summenformel | C6H4ClN3 |
| Durchschnittliche Molmasse | 153,57 g/mol |
| Monoisotopische Masse | 153,00937481 g/mol |
| SMILES | Clc1nccc2[nH]cnc12 |
| InChIKey | DHJMLXBBZRWBPW-UHFFFAOYSA-N |
| PubChem CID | 5373364 |
| ChEMBL | CHEMBL33524 |
| EC No. | 810-345-6 |
| DTXSID | DTXSID90418716 |
Chemische & physikalische Eigenschaften
| XLogP | 1,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 41,6 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 130 |
| Schmelzpunkt | 179-181 °C |
| Siedepunkt | 455.4±25.0 °C(Predicted) |
| Dichte | 1.531±0.06 g/cm3(Predicted) |
| Lagerbedingungen | under inert gas (nitrogen or Argon) at 2-8°C |
| Löslichkeit | DMSO (Slightly, Sonicated), Methanol (Slightly, Sonicated) |
| Aggregatzustand | Solid |
| pKa (Säurekonstante) | 7.93±0.40(Predicted) |
| Farbe | Pale Beige to Pale Brown |
| InChI | InChI=1S/C6H4ClN3/c7-6-5-4(1-2-8-6)9-3-10-5/h1-3H,(H,9,10) |
| InChIKey | DHJMLXBBZRWBPW-UHFFFAOYSA-N |
| SMILES | C1(Cl)=NC=CC2N=CNC1=2 |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 19 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
| Zollcode | 2933399990 |
Anwendungen & Verwendung
Verwenden
4-Chloro-1H-imidazo[4,5-c]pyridine is used as a reagent in the synthesis of 3-bromo-3-deazaneplanocin and 3-bromo-3-deazaaristeromycin, compounds which exhibit antiviral activity.