HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 830608Erstellt: 31. Oktober 2026
(1E,4E)-1,5-Bis(2-methoxyphenyl)penta-1,4-dien-3-one
TFEB activator 1 · RPN77612 · Curcumin analog C1 · Curcumin analog compound C1 · TFEB activator 1, 10 mM in DMSO · Curcumin analog C1(TFEB activator 1 ) · (1E,4E)-1,5-Bis(2-Methoxyphenyl)penta-1 · 1,5-Bis-(2-methoxy-phenyl)-penta-1,4-dien-3-one
https://huagongshe.com/de/chemical/830608
Identifikatoren & physikalische Daten
| CAS No. | 39777-61-2 |
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| Summenformel | C19H18O3 |
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| Durchschnittliche Molmasse | 294,3 g/mol |
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| Monoisotopische Masse | 294,12559443 g/mol |
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| SMILES | COc1ccccc1/C=C/C(=O)/C=C/c1ccccc1OC |
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| InChIKey | RCZMPCUUTSDNAJ-PHEQNACWSA-N |
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| PubChem CID | 830608 |
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| ChEMBL | CHEMBL477053 |
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| EC No. | 873-543-1 |
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Chemische & physikalische Eigenschaften
| XLogP | 4,1 |
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| Polarare Oberfläche (TPSA) | 35,5 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 6 |
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| Schwere Atome | 22 |
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| Formalladung | 0 |
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| Komplexität | 363 |
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| Schmelzpunkt | 120-122 °C(Solv: ethanol (64-17-5)water (7732-18-5)) |
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| Siedepunkt | 467.2±40.0 °C(Predicted) |
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| Dichte | 1.128±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | 2-8°C |
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| Löslichkeit | DMSO: 125 mg/mL (424.68 mM) |
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| Aggregatzustand | A solid |
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| Farbe | Light yellow to yellow |
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| InChI | InChI=1S/C19H18O3/c1-21-18-9-5-3-7-15(18)11-13-17(20)14-12-16-8-4-6-10-19(16)22-2/h3-14H,1-2H3/b13-11+,14-12+ |
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| InChIKey | RCZMPCUUTSDNAJ-PHEQNACWSA-N |
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| SMILES | C(/C1=CC=CC=C1OC)=C\C(=O)/C=C/C1=CC=CC=C1OC |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
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