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HCID 89178Erstellt: 25. Oktober 2026
Benzaldehyde, 4-(2-hydroxyethoxy)-
p-(2-Hydroxyethoxy)benzaldehyde · AKOS B030687 · TIMTEC-BB SBB010472 · ASINEX-REAG BAS 12719716 · Hydroxyethoxybenzaldehyde · 4-(2-HYDROXYETHOXY)BENZALDEHYDE · 4-(2-HYDROXYETHOXY)BENZALOIEHYDE · Benzaldehyde, 4-(2-hydroxyethoxy)-
https://huagongshe.com/de/chemical/89178
Identifikatoren & physikalische Daten
| CAS No. | 22042-73-5 |
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| Summenformel | C9H10O3 |
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| Durchschnittliche Molmasse | 166,17 g/mol |
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| Monoisotopische Masse | 166,06299418 g/mol |
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| SMILES | O=Cc1ccc(OCCO)cc1 |
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| InChIKey | VCDGTEZSUNFOKA-UHFFFAOYSA-N |
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| PubChem CID | 89178 |
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| ChEMBL | CHEMBL574227 |
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| EC No. | 695-647-4 |
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| DTXSID | DTXSID4066755 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,1 |
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| Polarare Oberfläche (TPSA) | 46,5 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 4 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 128 |
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| Schmelzpunkt | 36-38°C |
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| Siedepunkt | 335.2±17.0 °C(Predicted) |
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| Dichte | 1.194±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | Inert atmosphere,2-8°C |
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| pKa (Säurekonstante) | 14.14±0.10(Predicted) |
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| Aggregatzustand | powder to crystal |
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| Farbe | White to Light yellow to Light orange |
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| InChI | InChI=1S/C9H10O3/c10-5-6-12-9-3-1-8(7-11)2-4-9/h1-4,7,10H,5-6H2 |
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| InChIKey | VCDGTEZSUNFOKA-UHFFFAOYSA-N |
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| SMILES | C(=O)C1=CC=C(OCCO)C=C1 |
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| LogP (Verteilungskoeffizient) | 0.730 (est) |
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| CAS Datenbank | 22042-73-5(CAS DataBase Reference) |
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| EPA chemische Informationen | Benzaldehyde, 4-(2-hydroxyethoxy)- (22042-73-5) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (96.2%): Causes skin irritation [Warning Skin corrosion/irritation]P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)Aggregated GHS information provided per 26 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 (96.2%) |
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| TSCA-Inventar-Status | TSCA listed |
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| Zollcode | 2912490090 |
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| R-Sätze (R) | 36/37/38 |
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| Gefahrensymbole | Xi |
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| Sicherheitshinweise (S) | 26-36/37/39 |
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| Gefahrenklasse | IRRITANT |
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