HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-Methanesulfonylpyrimidine-4-carboxylic acid
2-methylsulfonylpyrimidine-4-carboxylicaci · 2-(methylsulfonyl)-4-Pyrimidinecarboxylic acid · 2-(Methylsulfonyl)pyriMidine-4-carboxylic acid · 4-Pyrimidinecarboxylic acid, 2-(methylsulfonyl)-
Identifikatoren & physikalische Daten
| CAS No. | 1370411-46-3 |
|---|---|
| Summenformel | C6H6N2O4S |
| Durchschnittliche Molmasse | 202,19 g/mol |
| Monoisotopische Masse | 202,00482767 g/mol |
| SMILES | CS(=O)(=O)c1nccc(C(=O)O)n1 |
| InChIKey | WSXZNFILTBDHHA-UHFFFAOYSA-N |
| PubChem CID | 21992201 |
| EC No. | 820-094-4 |
| DTXSID | DTXSID90621288 |
Chemische & physikalische Eigenschaften
| XLogP | -0,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 106 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 6 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 13 |
| Formalladung | 0 |
| Komplexität | 294 |
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 2 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%) |
| Alarmwort | Warnung |
| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
Anwendungen & Verwendung
Verwenden
2-Methanesulfonylpyrimidine-4-carboxylic acid