HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 586039Erstellt: 26. Oktober 2026
Methyl 6-methoxypyridine-3-carboxylate
RARECHEM AL BF 0896 · 6-methoxynicotinate · Methyl 6-methoxynicotite · METHYL 6-METHOXYNICOTINATE · Methyl 6-methoxynicotinat... · Methyl6-methoxynicotinate,98% · 6-METHOXYNICOTINIC ACID METHYL ESTER · Methyl 2-methoxypyridine-5-carboxylate
https://huagongshe.com/de/chemical/586039
Identifikatoren & physikalische Daten
| CAS No. | 26218-80-4 |
|---|
| Summenformel | C8H9NO3 |
|---|
| Durchschnittliche Molmasse | 167,16 g/mol |
|---|
| Monoisotopische Masse | 167,05824315 g/mol |
|---|
| SMILES | COC(=O)c1ccc(OC)nc1 |
|---|
| InChIKey | OVLDWZNVBDRZNN-UHFFFAOYSA-N |
|---|
| PubChem CID | 586039 |
|---|
| EC No. | 607-886-3 |
|---|
| DTXSID | DTXSID30342940 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 1 |
|---|
| Polarare Oberfläche (TPSA) | 48,4 |
|---|
| H-Brücken-Donoren | 0 |
|---|
| H-Brücken-Akzeptoren | 4 |
|---|
| Frei drehbare Bindungen | 3 |
|---|
| Schwere Atome | 12 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 160 |
|---|
| Schmelzpunkt | 48-53°C |
|---|
| Siedepunkt | 93 °C(Press: 3 Torr) |
|---|
| Dichte | 1.156±0.06 g/cm3(Predicted) |
|---|
| Lagerbedingungen | Inert atmosphere,Room Temperature |
|---|
| Aggregatzustand | crystalline solid |
|---|
| pKa (Säurekonstante) | 1.36±0.10(Predicted) |
|---|
| Farbe | White to off-white to faint orange |
|---|
| CAS Datenbank | 26218-80-4(CAS DataBase Reference) |
|---|
| NIST chemische Informationen | 6-Hydroxynicotinic acid di-methyl derivative(26218-80-4) |
|---|
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)Aggregated GHS information provided per 7 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
|---|
| Zollcode | 2933399990 |
|---|
| R-Sätze (R) | 20/21/22 |
|---|
| Gefahrensymbole | Xi |
|---|
| hazard_note | Irritant |
|---|
| Sicherheitshinweise (S) | 36 |
|---|
