HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 76959Erstellt: 27. Oktober 2026
4-Methoxybenzamid
P-METHOXYBENZAMIDE · 4-ANISAMIDE · P-ANISAMIDE · 4-methoxy-benzamid · 4-METHOXYBENZAMIDE · 4-Methoxybenzamide>Benzamide, 4-methoxy- · 4-Methoxybenzamide,97% · 4-Methoxyphenylformamide
https://huagongshe.com/de/chemical/76959
Identifikatoren & physikalische Daten
| CAS No. | 3424-93-9 |
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| Summenformel | C8H9NO2 |
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| Durchschnittliche Molmasse | 151,16 g/mol |
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| Monoisotopische Masse | 151,06332853 g/mol |
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| SMILES | COc1ccc(C(N)=O)cc1 |
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| InChIKey | GUCPYIYFQVTFSI-UHFFFAOYSA-N |
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| PubChem CID | 76959 |
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| ChEMBL | CHEMBL449635 |
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| ChEBI | CHEBI:194912 |
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| EC No. | 222-319-6 |
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| DTXSID | DTXSID40879434 |
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| Lokaler Name | 4-Methoxybenzamid |
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Chemische & physikalische Eigenschaften
| XLogP | 0,9 |
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| Polarare Oberfläche (TPSA) | 52,3 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 11 |
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| Formalladung | 0 |
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| Komplexität | 139 |
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| SpringerMaterials Properties | Chemical shift |
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| LogP (Verteilungskoeffizient) | 0.86 |
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| Endocrine Disruptors | Potential endocrine disrupting compound |
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| Schmelzpunkt | 164-167 °C (lit.) |
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| Siedepunkt | 295°C |
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| Dichte | 1.2023 (rough estimate) |
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| Brechungsindex | 1.5810 (rough estimate) |
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| Flammpunkt | 295°C |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| Aggregatzustand | Crystalline Powder |
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| pKa (Säurekonstante) | 16.34±0.50(Predicted) |
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| Farbe | White |
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| BRN | 1862847 |
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| InChI | InChI=1S/C8H9NO2/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H2,9,10) |
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| InChIKey | GUCPYIYFQVTFSI-UHFFFAOYSA-N |
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| SMILES | C(N)(=O)C1=CC=C(OC)C=C1 |
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| CAS Datenbank | 3424-93-9(CAS DataBase Reference) |
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| NIST chemische Informationen | p-Methoxybenzamide(3424-93-9) |
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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 5 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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| Wassergefährdungsklasse (WGK) | 3 |
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| Zollcode | 29242990 |
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| RTECS-Nr. | CV5466666 |
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| R-Sätze (R) | 36/37/38 |
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| Sicherheitshinweise (S) | 22-24/25 |
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| Lagerklasse | 11 - Combustible Solids |
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