HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Natrium-1,2,3,6-tetrahydro-2,6-dioxopyrimidin-4-carboxylat
orotic acid sodium salt · ate(1:1:1) · OROTIC ACID, NA SALT · sodiumorotatehydrate · Sodiumorotateanhydrous · orotic acid monosodium · monosodiumorolatehydrate · OROTIC ACID MONOSODIUM SALT
Identifikatoren & physikalische Daten
| CAS No. | 154-85-8 |
|---|---|
| Summenformel | C5H3N2NaO4 |
| Durchschnittliche Molmasse | 178,08 g/mol |
| Monoisotopische Masse | 177,99905086 g/mol |
| SMILES | O=C([O-])c1cc(=O)[nH]c(=O)[nH]1.[Na+] |
| InChIKey | ZTHMWDSJKLNDTE-UHFFFAOYSA-M |
| PubChem CID | 23683036 |
| ChEBI | CHEBI:132101 |
| EC No. | 205-834-0 |
| DTXSID | DTXSID1021083 |
| Lokaler Name | Natrium-1,2,3,6-tetrahydro-2,6-dioxopyrimidin-4-carboxylat |
Chemische & physikalische Eigenschaften
| Polarare Oberfläche (TPSA) | 98,3 |
|---|---|
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 4 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 12 |
| Formalladung | 0 |
| Komplexität | 273 |
| Stoffklassen | Nitrogen Compounds -> Pyrimidines |
| Physical Description | Solid[Sigma-Aldrich MSDS] |
| LogP (Verteilungskoeffizient) | -0.928 (est) |
| CAS Datenbank | 154-85-8 |
Sicherheit & Vorschriften
| Gefahrenübersicht | Not considered hazardous by GHS classification[Sigma-Aldrich MSDS] |
|---|---|
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29335990 |
| RTECS-Nr. | RM3201700 |
| Sicherheitshinweise (S) | 24/25 |
Anwendungen & Verwendung
Verwenden
Orotic Acid Monosodium Salt is used in the formation of a complex with lanthanium(III) which displats cytotoxic activity on different tumor cell lines.Also, it is the unlabeled form of Orotic Acid-15N2 Monosodium Salt (O691517), which is an intermediate used in the synthesis of Orotic Acid-15N2 Monohydrate (O691504), which is a labeled analogue of Orotic Acid Monohydrade (O691500), which is used in the preparation of therapeutic agents for chronic obstructive pulmonary disease (COPD) treatment.