HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 2769420Erstellt: 23. Oktober 2026
5-Phenyl-2-furaldehyde
AKOS BAR-0555 · ASISCHEM R39511 · 5-Phenylfurfural · 2-ForMyl-5-phenylfuran · 5-Phenyl-2-furaldehyde · 5-Phenyl-2-furaldehyde 96% · 5-PHENYL-FURAN-2-CARBALDEHYDE · 5-Phenyl-2-furancarboxaldehyde
https://huagongshe.com/de/chemical/2769420
Identifikatoren & physikalische Daten
| CAS No. | 13803-39-9 |
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| Summenformel | C11H8O2 |
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| Durchschnittliche Molmasse | 172,18 g/mol |
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| Monoisotopische Masse | 172,0524295 g/mol |
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| SMILES | O=Cc1ccc(-c2ccccc2)o1 |
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| InChIKey | BMJHNNPEPBZULA-UHFFFAOYSA-N |
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| PubChem CID | 2769420 |
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| ChEMBL | CHEMBL4526187 |
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| EC No. | 626-945-4 |
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| DTXSID | DTXSID20377726 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,9 |
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| Polarare Oberfläche (TPSA) | 30,2 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 173 |
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| Schmelzpunkt | 29-33 °C (lit.) |
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| Siedepunkt | 146℃ (5 Torr) |
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| Dichte | 1.154±0.06 g/cm3(Predicted) |
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| Flammpunkt | >230 °F |
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| Lagerbedingungen | under inert gas (nitrogen or Argon) at 2–8 °C |
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| Aggregatzustand | Solid or Lliquid |
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| Farbe | Yellow to green to brown |
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| InChI | 1S/C11H8O2/c12-8-10-6-7-11(13-10)9-4-2-1-3-5-9/h1-8H |
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| InChIKey | BMJHNNPEPBZULA-UHFFFAOYSA-N |
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| SMILES | O=Cc1ccc(o1)-c2ccccc2 |
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| CAS Datenbank | 13803-39-9(CAS DataBase Reference) |
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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 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 | Skin Irrit. 2 (100%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| Zollcode | 2932190090 |
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| R-Sätze (R) | 36/37/38 |
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| Gefahrensymbole | Xi |
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| Sicherheitshinweise (S) | 26-36 |
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| Lagerklasse | 11 - Combustible Solids |
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| Gefahrenklasse | Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
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