HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 77611Erstellt: 31. Oktober 2026
7-Acetoxy-6-allyl-4,8-dimethylcoumarin
WPXKHUHUPSKNMM-UHFFFAOYSA-N · 7-ACETOXY-6-ALLYL-4,8-DIMETHYLCOUMARIN · 7-(Acetyloxy)-4,8-dimethyl-6-(2-propenyl)-2H-1-benzopyran-2-one · 2H-1-Benzopyran-2-one, 7-(acetyloxy)-4,8-dimethyl-6-(2-propen-1-yl)-
https://huagongshe.com/de/chemical/77611
Identifikatoren & physikalische Daten
| CAS No. | 3993-45-1 |
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| Summenformel | C16H16O4 |
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| Durchschnittliche Molmasse | 272,29 g/mol |
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| Monoisotopische Masse | 272,10485899 g/mol |
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| SMILES | C=CCc1cc2c(C)cc(=O)oc2c(C)c1OC(C)=O |
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| InChIKey | WPXKHUHUPSKNMM-UHFFFAOYSA-N |
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| PubChem CID | 77611 |
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| EC No. | 635-141-2 |
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| DTXSID | DTXSID8063256 |
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Chemische & physikalische Eigenschaften
| XLogP | 3 |
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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 | 4 |
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| Schwere Atome | 20 |
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| Formalladung | 0 |
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| Komplexität | 451 |
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| EPA chemische Informationen | 2H-1-Benzopyran-2-one, 7-(acetyloxy)-4,8-dimethyl-6-(2-propenyl)- (3993-45-1) |
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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 39 reports by companies from 2 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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| TSCA-Inventar-Status | TSCA listed |
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