HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 99860Erstellt: 27. Oktober 2026
2,5-Dibromadipinsure
2,5-Dibromoadipic acid · 2,2'-DIBROMO ADIPIC ACID · 2,5-Dibromohexanedioic acid · Hexanedioic acid, 2,5-dibromo-
https://huagongshe.com/de/chemical/99860
Identifikatoren & physikalische Daten
| CAS No. | 3479-85-4 |
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| Summenformel | C6H8Br2O4 |
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| Durchschnittliche Molmasse | 303,93 g/mol |
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| Monoisotopische Masse | 301,87893294 g/mol |
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| SMILES | O=C(O)C(Br)CCC(Br)C(=O)O |
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| InChIKey | KABAKEOYQZKPBA-UHFFFAOYSA-N |
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| PubChem CID | 99860 |
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| EC No. | 222-457-7 |
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| DTXSID | DTXSID00956270 |
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| Lokaler Name | 2,5-Dibromadipinsure |
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Chemische & physikalische Eigenschaften
| XLogP | 1,7 |
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| Polarare Oberfläche (TPSA) | 74,6 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 5 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 162 |
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| Schmelzpunkt | 188°C |
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| Siedepunkt | 395.4±42.0 °C(Predicted) |
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| Dichte | 2.111±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | under inert gas (nitrogen or Argon) at 2–8 °C |
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| pKa (Säurekonstante) | 2.45±0.23(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Acute Tox. 4 (100%) |
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| Gefahrensymbole | Xi |
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| Gefahrenklasse | IRRITANT |
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