HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 71464713Erstellt: 2. November 2026
Acoramidis
Acoramidis · 3-(3-(3,5-dimethyl-1H-pyrazol-4-yl)propoxy)-4-fluorobenzoic acid · AG10,AG 10 · Acoramidis (AG-10) · AG-10 1446711-81-4 · AG-10, 10 mM in DMSO · Benzoic acid, 3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propoxy]-4-fluoro- · 3-[3-(3,5-Dimethyl-1H-pyrazol-4-yl)propoxy]-4-fluorobenzoic acid (ACI)
https://huagongshe.com/de/chemical/71464713
Identifikatoren & physikalische Daten
| CAS No. | 1446711-81-4 |
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| Summenformel | C15H17FN2O3 |
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| Durchschnittliche Molmasse | 292,3 g/mol |
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| Monoisotopische Masse | 292,12232057 g/mol |
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| SMILES | Cc1n[nH]c(C)c1CCCOc1cc(C(=O)O)ccc1F |
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| InChIKey | WBFUHHBPNXWNCC-UHFFFAOYSA-N |
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| PubChem CID | 71464713 |
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| ChEMBL | CHEMBL3940890 |
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| EC No. | 950-296-9 |
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| DTXSID | DTXSID501358946 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,9 |
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| Polarare Oberfläche (TPSA) | 75,2 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 6 |
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| Schwere Atome | 21 |
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| Formalladung | 0 |
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| Komplexität | 356 |
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| Löslichkeit | ≥12 micrograms/mLDMSO: Soluble: =10 mg/mlEthanol: Slightly soluble: 0.1-1 mg/ml |
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| Human Drugs | Breast FeedingLactationMilk, HumanEMA approved medicines: Human medicine |
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| Siedepunkt | 542.5±50.0 °C(Predicted) |
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| Dichte | 1.282±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 3.98±0.10(Predicted) |
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| Aggregatzustand | Solid |
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| Farbe | White to off-white |
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| InChI | InChI=1S/C15H17FN2O3/c1-9-12(10(2)18-17-9)4-3-7-21-14-8-11(15(19)20)5-6-13(14)16/h5-6,8H,3-4,7H2,1-2H3,(H,17,18)(H,19,20) |
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| InChIKey | WBFUHHBPNXWNCC-UHFFFAOYSA-N |
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| SMILES | C(O)(=O)C1=CC=C(F)C(OCCCC2=C(C)NN=C2C)=C1 |
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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)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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| Hepatotoxicity | In the registration trial of acoramidis, transient mild ALT and AST elevations were not uncommon, but elevations in ALT above 3 times ULN were infrequent and no more common with acoramidis than placebo (0.9% vs 0.5%), most of which were attributed to heart failure or its treatment. No patient required drug discontinuation because of liver test abnormalities and none developed clinically apparent liver injury or elevations in serum aminotransferases accompanied by jaundice. Since its approval, clinical experience with acoramidis has been limited, but there have been no published case reports of clinically apparent liver injury attributed to its use. |
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| Effects During Pregnancy and Lactation | ◉ Summary of Use during Lactation |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H315 |
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