HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 9688521Erstellt: 3. November 2026
4-Bromo-2-(2-(2-iodobenzoyl)carbohydrazonoyl)phenyl 4-methoxybenzoate
SALOR-INT L393002-1EA · 4-BROMO-2-(2-(2-IODOBENZOYL)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE
https://huagongshe.com/de/chemical/9688521
Identifikatoren & physikalische Daten
| CAS No. | 769151-13-5 |
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| Summenformel | C22H16BrIN2O4 |
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| Durchschnittliche Molmasse | 579,2 g/mol |
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| Monoisotopische Masse | 577,93382 g/mol |
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| SMILES | COc1ccc(C(=O)Oc2ccc(Br)cc2/C=N/NC(=O)c2ccccc2I)cc1 |
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| InChIKey | JNPYEZYPOUJRQV-DHRITJCHSA-N |
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| PubChem CID | 9688521 |
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| EC No. | 649-728-6 |
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Chemische & physikalische Eigenschaften
| XLogP | 5,6 |
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| Polarare Oberfläche (TPSA) | 77 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 7 |
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| Schwere Atome | 30 |
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| Formalladung | 0 |
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| Komplexität | 612 |
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| Dichte | 1.668±0.14 g/cm3(Temp: 25 °CPress: 760 Torr)(predicted) |
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| pKa (Säurekonstante) | 11.045±0.46(predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]P273, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Aquatic Acute 1 (100%) |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H410 |
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