HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 80201Erstellt: 4. November 2026
Ethyl-4-methoxy-6-methylsalicylat
Ethyl everninate · Einecs 228-073-6 · ethyl 4-methoxy-6-methylsalicylate · Ethyl 2-hydroxy-4-methoxy-6-methylbenzoate · 2-hydroxy-4-methoxy-6-methyl-benzoic acid ethyl ester · Benzoic acid, 2-hydroxy-4-methoxy-6-methyl-, ethyl ester
https://huagongshe.com/de/chemical/80201
Identifikatoren & physikalische Daten
| CAS No. | 6110-36-7 |
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| Summenformel | C11H14O4 |
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| Durchschnittliche Molmasse | 210,23 g/mol |
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| Monoisotopische Masse | 210,08920892 g/mol |
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| SMILES | CCOC(=O)c1c(C)cc(OC)cc1O |
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| InChIKey | PJOOIAZRUIIQMU-UHFFFAOYSA-N |
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| PubChem CID | 80201 |
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| ChEMBL | CHEMBL1318588 |
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| ChEBI | CHEBI:108584 |
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| EC No. | 228-073-6 |
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| DTXSID | DTXSID1064116 |
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| Lokaler Name | Ethyl-4-methoxy-6-methylsalicylat |
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Chemische & physikalische Eigenschaften
| XLogP | 2,7 |
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| Polarare Oberfläche (TPSA) | 55,8 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 4 |
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| Schwere Atome | 15 |
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| Formalladung | 0 |
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| Komplexität | 217 |
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| Endocrine Disruptors | Potential endocrine disrupting compound |
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| Schmelzpunkt | 87 °C |
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| Siedepunkt | 317.3±37.0 °C(Predicted) |
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| Dichte | 1.151±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 9.66±0.15(Predicted) |
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| InChI | InChI=1S/C11H14O4/c1-4-15-11(13)10-7(2)5-8(14-3)6-9(10)12/h5-6,12H,4H2,1-3H3 |
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| InChIKey | PJOOIAZRUIIQMU-UHFFFAOYSA-N |
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| SMILES | C(OCC)(=O)C1=C(C)C=C(OC)C=C1O |
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| EPA chemische Informationen | Benzoic acid, 2-hydroxy-4-methoxy-6-methyl-, ethyl ester (6110-36-7) |
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Sicherheit & Vorschriften
| Regulatorische Informationen | Chemical: Benzoic acid, 2-hydroxy-4-methoxy-6-methyl-, ethyl ester |
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| Weitere Sicherheitsinformationen | Evaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia |
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| TSCA-Inventar-Status | TSCA listed |
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