HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 15749Erstellt: 24. Oktober 2026
p-Nitrocumol
4-Nitrocumol · P-NITROCUMENE · 4-NITROCUMENE · Cumene, p-nitro- · PARA-NITROCUMENE · 4-Nitrocumene>4-Isopropylmtrobenzene · P-NITROISOPROPYLBENZENE · 4-ISOPROPYLNITROBENZENE
https://huagongshe.com/de/chemical/15749
Identifikatoren & physikalische Daten
| CAS No. | 1817-47-6 |
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| Summenformel | C9H11NO2 |
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| Durchschnittliche Molmasse | 165,19 g/mol |
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| Monoisotopische Masse | 165,07897859 g/mol |
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| SMILES | CC(C)c1ccc([N+](=O)[O-])cc1 |
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| InChIKey | JXMYUMNAEKRMIP-UHFFFAOYSA-N |
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| PubChem CID | 15749 |
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| EC No. | 217-326-6 |
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| DTXSID | DTXSID6061991 |
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| Lokaler Name | p-Nitrocumol |
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Chemische & physikalische Eigenschaften
| XLogP | 3,5 |
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| Polarare Oberfläche (TPSA) | 45,8 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 154 |
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| SpringerMaterials Properties | 13C nuclear magnetic resonance spectrum |
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| Schmelzpunkt | 35.17°C (estimate) |
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| Siedepunkt | 106-107 °C11 mm Hg(lit.) |
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| Dichte | 1.09 g/mL at 25 °C(lit.) |
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| Brechungsindex | n20/D 1.537(lit.) |
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| Flammpunkt | >230 °F |
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| Lagerbedingungen | 2-8°C |
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| Aggregatzustand | clear liquid |
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| Farbe | Light yellow to Brown |
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| Henry-Konstante | 2.4×10-1 mol/(m3Pa) at 25℃, Zhang et al. (2010) |
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| Stabilität | Stable. Incompatible with strong bases, strong oxidizing agents. |
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| CAS Datenbank | 1817-47-6(CAS DataBase Reference) |
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| EPA chemische Informationen | p-Nitrocumene (1817-47-6) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (97.6%): 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 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatorische Informationen | Chemical: Benzene, 1-(1-methylethyl)-4-nitro- |
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| Weitere Sicherheitsinformationen | Evaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia |
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| Hazard Classes and Categories | Skin Irrit. 2 (97.6%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| TSCA-Inventar-Status | TSCA listed |
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| Zollcode | 2909309090 |
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| R-Sätze (R) | 36/37/38 |
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| Gefahrensymbole | Xi |
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| Sicherheitshinweise (S) | 26-36 |
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