HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 33804Erstellt: 5. November 2026
Malononitrile, (p-(benzyloxy)benzylidene)-
2-(4-BENZYLOXY-BENZYLIDENE)-MALONONITRILE · 2-[[4-(Phenylmethoxy)phenyl]methylene]propanedinitrile · Propanedinitrile, 2-[[4-(phenylmethoxy)phenyl]methylene]-
https://huagongshe.com/de/chemical/33804
Identifikatoren & physikalische Daten
| CAS No. | 27389-83-9 |
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| Summenformel | C17H12N2O |
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| Durchschnittliche Molmasse | 260,29 g/mol |
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| Monoisotopische Masse | 260,09496301 g/mol |
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| SMILES | N#CC(C#N)=Cc1ccc(OCc2ccccc2)cc1 |
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| InChIKey | GBQGNEMSQIQFRK-UHFFFAOYSA-N |
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| PubChem CID | 33804 |
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| EC No. | 167-642-2 |
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| DTXSID | DTXSID10181814 |
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Chemische & physikalische Eigenschaften
| XLogP | 3,3 |
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| Polarare Oberfläche (TPSA) | 56,8 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 3 |
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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 | 404 |
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| Schmelzpunkt | 156 °C(Solv: isopropanol (67-63-0)) |
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| Siedepunkt | 457.4±35.0 °C(Predicted) |
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| Dichte | 1.192±0.06 g/cm3(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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