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HCID 2759699Erstellt: 27. Oktober 2026
Methyl-3-(p-methoxyphenyl)-3-oxopropionat
METHYL 3-(4-METHOXYPHENYL)-3-OXOPROPANOATE · EINECS 244-732-0 · CBI-BB ZERO/004684 · MTHYL4-METHOXYBENZOYLACETATE · METHY 4-METHOXYBENZOYLACETATE · METHYL 4-METHOXYBENZOYLACETATE · Methyl 4-methoxy-β-oxobenzenepropanoate · Methyl-3-(p-methoxyphenyl)-3-oxopropionat
https://huagongshe.com/de/chemical/2759699
Identifikatoren & physikalische Daten
| CAS No. | 22027-50-5 |
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| Summenformel | C11H12O4 |
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| Durchschnittliche Molmasse | 208,21 g/mol |
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| Monoisotopische Masse | 208,07355886 g/mol |
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| SMILES | COC(=O)CC(=O)c1ccc(OC)cc1 |
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| InChIKey | VXXOASOINNOPGR-UHFFFAOYSA-N |
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| PubChem CID | 2759699 |
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| EC No. | 244-732-0 |
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| DTXSID | DTXSID10885188 |
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| Lokaler Name | Methyl-3-(p-methoxyphenyl)-3-oxopropionat |
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Chemische & physikalische Eigenschaften
| XLogP | 1,6 |
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| Polarare Oberfläche (TPSA) | 52,6 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 5 |
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| Schwere Atome | 15 |
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| Formalladung | 0 |
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| Komplexität | 229 |
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| Endocrine Disruptors | Potential endocrine disrupting compound |
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| Schmelzpunkt | 40-42°C |
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| Siedepunkt | 135°C/0.27mm |
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| Dichte | 1.147±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | Store at room temperature |
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| pKa (Säurekonstante) | 10.31±0.25(Predicted) |
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| CAS Datenbank | 22027-50-5(CAS DataBase Reference) |
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| EPA chemische Informationen | Methyl 4-methoxy-.beta.-oxobenzenepropionate (22027-50-5) |
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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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatorische Informationen | PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance. |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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| TSCA-Inventar-Status | TSCA listed |
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