HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 11980Erstellt: 27. Oktober 2026
Ethylfuroat
ETHYL FUROATE · ETHYL PYROMUCATE · RARECHEM AL BI 0007 · ethyl α-furancarboxylate · ETHYL 2-FURANCARBOXYLATE · 2-FUROIC ACID ETHYL ESTER · ETHYL 2-FUROATE USP/EP/BP · Furancarboxylic acid, ethyl ester
https://huagongshe.com/de/chemical/11980
Identifikatoren & physikalische Daten
| CAS No. | 1335-40-6 |
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| Summenformel | C7H8O3 |
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| Durchschnittliche Molmasse | 140,14 g/mol |
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| Monoisotopische Masse | 140,04734412 g/mol |
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| SMILES | CCOC(=O)c1ccco1 |
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| InChIKey | NHXSTXWKZVAVOQ-UHFFFAOYSA-N |
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| PubChem CID | 11980 |
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| ChEMBL | CHEMBL4634762 |
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| ChEBI | CHEBI:169174 |
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| EC No. | 210-404-0 |
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| DTXSID | DTXSID0060640 |
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| Lokaler Name | Ethylfuroat |
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Chemische & physikalische Eigenschaften
| XLogP | 1,5 |
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| Polarare Oberfläche (TPSA) | 39,4 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 3 |
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| Schwere Atome | 10 |
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| Formalladung | 0 |
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| Komplexität | 122 |
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| SpringerMaterials Properties | Boiling point |
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| LogP (Verteilungskoeffizient) | 1.57 |
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| Dichte | 1.1174 @ 21°C1.117 g/mL at 25 °C(lit.) |
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| Aromastoffe | EU Flavoring substances |
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| Siedepunkt | 196.8 °C @760 [mm Hg]196 °C(lit.) |
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| Schmelzpunkt | 34.5 °C32-37 °C(lit.) |
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| Flammpunkt | 158 °F |
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| Lagerbedingungen | 2-8°C |
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| InChI | InChI=1S/C7H8O3/c1-2-9-7(8)6-4-3-5-10-6/h3-5H,2H2,1H3 |
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| InChIKey | NHXSTXWKZVAVOQ-UHFFFAOYSA-N |
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| SMILES | C1(OC=CC=1)C(=O)OCC |
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| LogP (Verteilungskoeffizient) | 1.612 (est) |
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| CAS Datenbank | 1335-40-6(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 98.9% (89 of 90) of all reports.Not ClassifiedAggregated GHS information provided per 90 reports by companies from 2 notifications to the ECHA C&L Inventory. |
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| Regulatorische Informationen | Chemical: 2-Furancarboxylic acid, ethyl esterCommission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)2-Furancarboxylic acid, ethyl ester: Does not have an individual approval but may be used under an appropriate group standard |
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| Hazard Classes and Categories | Not Classified |
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| Protective Action Criteria (PAC) | 0.59 [mg/m3]6.5 [mg/m3]39 [mg/m3] |
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| Wassergefährdungsklasse (WGK) | 3 |
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| RTECS-Nr. | LV1850000 |
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| R-Sätze (R) | 11 |
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| Gefahrensymbole | F |
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| Sicherheitshinweise (S) | 16 |
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