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Methyl 2-(chloromethyl)pyridine-3-carboxylate
Methyl 2-(chloromethyl)nicotinate · 2-Chloromethyl-nicotinic acid methyl ester · Methyl 2-(chloromethyl)nicotinate - [M70459] · methyl 2-(chloromethyl)pyridine-3-carboxylate · METHYL 2-(CHLOROMETHYL)NICOTINATE ISO 9001：2015 REACH · 2-ChloroMethyl-Pyridine-3-Carboxylic Acid Methyl Ester · 3-Pyridinecarboxylic acid, 2-(chloromethyl)-, methyl ester
Identifikatoren & physikalische Daten
| CAS No. | 177785-14-7 |
|---|---|
| Summenformel | C8H8ClNO2 |
| Durchschnittliche Molmasse | 185,61 g/mol |
| Monoisotopische Masse | 185,02435618 g/mol |
| SMILES | COC(=O)c1cccnc1CCl |
| InChIKey | AMIVNKVBDFJAFD-UHFFFAOYSA-N |
| PubChem CID | 19081344 |
| EC No. | 862-201-7 |
| DTXSID | DTXSID00597889 |
Chemische & physikalische Eigenschaften
| XLogP | 1,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 39,2 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 12 |
| Formalladung | 0 |
| Komplexität | 163 |
| Siedepunkt | 279.4±30.0 °C(Predicted) |
| Dichte | 1.252±0.06 g/cm3(Predicted) |
| Lagerbedingungen | 2-8°C |
| pKa (Säurekonstante) | 1.67±0.22(Predicted) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
| Alarmwort | Achtung |
| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
Anwendungen & Verwendung
Verwenden
Methyl 2-(chloromethyl)nicotinate is an intermediate used in synthesizing NAI 1 (N215005), which is used in the process of visualizing the physical basis for molecular behavious inside living cells. RNAs are central to biological regulation and this molecule aids in the first global view of RNA secondary structures in living cells for all four bases.