HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Isocil
H-82 · isocil · H82sclc · Isoprocil · Herbicide 82 · 5-BROMO-3-ISOPROPYL-6-METHYLURACIL · NCI-H82 Cells Line[H82 Cells Line] · 5-bromo-6-methyl-3-propan-2-yl-1H-pyrimidine-2,4-dione
Identifikatoren & physikalische Daten
| CAS No. | 314-42-1 |
|---|---|
| Summenformel | C8H11BrN2O2 |
| Durchschnittliche Molmasse | 247,09 g/mol |
| Monoisotopische Masse | 246,00038969 g/mol |
| SMILES | Cc1[nH]c(=O)n(C(C)C)c(=O)c1Br |
| InChIKey | PSYBGEADHLUXCS-UHFFFAOYSA-N |
| PubChem CID | 9412 |
| ChEMBL | CHEMBL1901703 |
| ChEBI | CHEBI:82230 |
| EC No. | 206-247-2 |
| DTXSID | DTXSID2042064 |
| Lokaler Name | Isocil |
Chemische & physikalische Eigenschaften
| XLogP | 1,6 |
|---|---|
| Polarare Oberfläche (TPSA) | 49,4 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 13 |
| Formalladung | 0 |
| Komplexität | 297 |
| Schmelzpunkt | 158-159° |
| Dichte | 1.6046 (rough estimate) |
| Brechungsindex | 1.5140 (estimate) |
| Löslichkeit | 2.15g/L(25 ºC) |
| EPA chemische Informationen | Isocil (314-42-1) |
Sicherheit & Vorschriften
| Regulatorische Informationen | 2,4(1H,3H)-Pyrimidinedione, 5-bromo-6-methyl-3-(1-methylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2,4(1H,3H)-Pyrimidinedione, 5-bromo-6-methyl-3-(1-methylethyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711) |
|---|---|
| Toxizität | LD50 orally in rats: 3400 mg/kg (Bailey, White) |
Anwendungen & Verwendung
Verwenden
Herbicide.