HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 22747Erstellt: 27. Oktober 2026
1,4-Dibromo-2,3-butanedione
SKL239 · SYM-DIBROMODIACETYL · 1,4-DIBROMODIACETYL · à,à'-dibromobiacetyl · 2,2’-dibromobiacetyl · 1,4-dibromobutanedione · 1,4-dibromo-3-butanedione · 1,4-dibromobutane-2,3-dione
https://huagongshe.com/de/chemical/22747
Identifikatoren & physikalische Daten
| CAS No. | 6305-43-7 |
|---|
| Summenformel | C4H4Br2O2 |
|---|
| Durchschnittliche Molmasse | 243,88 g/mol |
|---|
| Monoisotopische Masse | 241,8578 g/mol |
|---|
| SMILES | O=C(CBr)C(=O)CBr |
|---|
| InChIKey | RZMOICJDRADLCT-UHFFFAOYSA-N |
|---|
| PubChem CID | 22747 |
|---|
| ChEBI | CHEBI:188852 |
|---|
| EC No. | 228-615-1 |
|---|
| DTXSID | DTXSID9064219 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 1,2 |
|---|
| Polarare Oberfläche (TPSA) | 34,1 |
|---|
| H-Brücken-Donoren | 0 |
|---|
| H-Brücken-Akzeptoren | 2 |
|---|
| Frei drehbare Bindungen | 3 |
|---|
| Schwere Atome | 8 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 96 |
|---|
| Physical Description | Light yellow powder[Aldrich MSDS] Irritating odor[Alfa Aesar MSDS] |
|---|
| Schmelzpunkt | 117-119 °C (lit.) |
|---|
| Siedepunkt | 213.0±25.0 °C(Predicted) |
|---|
| Dichte | 2.0524 (rough estimate) |
|---|
| Brechungsindex | 1.5220 (estimate) |
|---|
| Lagerbedingungen | Storage temp. 2-8°C |
|---|
| Aggregatzustand | powder |
|---|
| Löslichkeit | Insoluble in water. |
|---|
| BRN | 970154 |
|---|
| InChI | InChI=1S/C4H4Br2O2/c5-1-3(7)4(8)2-6/h1-2H2 |
|---|
| InChIKey | RZMOICJDRADLCT-UHFFFAOYSA-N |
|---|
| SMILES | C(Br)C(=O)C(=O)CBr |
|---|
| CAS Datenbank | 6305-43-7(CAS DataBase Reference) |
|---|
| EPA chemische Informationen | 2,3-Butanedione, 1,4-dibromo- (6305-43-7) |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (90.7%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (90.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (90.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract 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 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|
| Gefahrenübersicht | Causes acute pulmonary edema and diffuse hepatitis in intravenous lethal-dose studies of dogs[RTECS] A skin and strong eye irritant[Aldrich MSDS] Causes burnsInhalation may cause corrosive injuries to upper respiratory tract and lungsHarmful by ingestion[Alfa Aesar MSDS] |
|---|
| Hazard Classes and Categories | Skin Irrit. 2 (90.7%)Eye Irrit. 2 (90.7%)STOT SE 3 (90.7%) |
|---|
| Unerwünschte Wirkungen | Occupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.Dermatotoxin - Skin burns. |
|---|
| Wassergefährdungsklasse (WGK) | 3 |
|---|
| TSCA-Inventar-Status | TSCA listed |
|---|
| UN-Transportnummer | 1759 |
|---|
| RTECS-Nr. | EK2850000 |
|---|
| R-Sätze (R) | 36/37/38 |
|---|
| Gefahrensymbole | Xi |
|---|
| Sicherheitshinweise (S) | 26-36/37/39-37/39-27 |
|---|
| Gefahrenklasse | 8Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
|---|
| Verpackungsgruppe | III |
|---|
| Lagerklasse | 11 - Combustible Solids |
|---|
