HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 298628Erstellt: 27. Oktober 2026
5-Bromo-2,4-dimethyl-1,3-thiazole
5-bromo-2,4-dimethylthiazole · Thiazole,5-bromo-2,4-dimethyl- · 5-Bromo-2,4-dimethyl-1,3-thiazole
https://huagongshe.com/de/chemical/298628
Identifikatoren & physikalische Daten
| CAS No. | 28599-52-2 |
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| Summenformel | C5H6BrNS |
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| Durchschnittliche Molmasse | 192,08 g/mol |
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| Monoisotopische Masse | 190,94043229 g/mol |
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| SMILES | Cc1nc(C)c(Br)s1 |
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| InChIKey | BSFCVAYFJQLZEU-UHFFFAOYSA-N |
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| PubChem CID | 298628 |
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| EC No. | 639-330-0 |
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| DTXSID | DTXSID50305471 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,8 |
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| Polarare Oberfläche (TPSA) | 41,1 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 8 |
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| Formalladung | 0 |
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| Komplexität | 88,5 |
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| Schmelzpunkt | 153-155 °C |
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| Siedepunkt | 188-190 °C(Press: 745 Torr) |
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| Dichte | 1.589±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | Storage temp. 2-8°C |
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| pKa (Säurekonstante) | 2.93±0.10(Predicted) |
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| Aggregatzustand | solid |
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| InChI | 1S/C5H6BrNS/c1-3-5(6)8-4(2)7-3/h1-2H3 |
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| InChIKey | BSFCVAYFJQLZEU-UHFFFAOYSA-N |
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| SMILES | CC1=C(Br)SC(C)=N1 |
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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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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| Wassergefährdungsklasse (WGK) | WGK 3 |
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| Zollcode | 2934100090 |
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| R-Sätze (R) | 36/37/38 |
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| Gefahrensymbole | Xi |
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| hazard_note | Irritant |
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| Sicherheitshinweise (S) | 26-37/39 |
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| Lagerklasse | 11 - Combustible Solids |
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| Gefahrenklasse | Acute Tox. 4 Oral |
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