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HCID 84271Erstellt: 25. Oktober 2026
2,4,6-Trimethoxyanilin
140642 · 2,4,6-Trimethoxyanilin · 2,4,6-TRIMETHOXYANILINE · Phloroglucinol Impurity 37 · 2,4,6-Trimethoxybenzenamine · Benzenamine, 2,4,6-trimethoxy- · 1-AMINO-2,4,6-TRIMETHOXYBENZENE
https://huagongshe.com/de/chemical/84271
Identifikatoren & physikalische Daten
| CAS No. | 14227-17-9 |
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| Summenformel | C9H13NO3 |
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| Durchschnittliche Molmasse | 183,2 g/mol |
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| Monoisotopische Masse | 183,08954328 g/mol |
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| SMILES | COc1cc(OC)c(N)c(OC)c1 |
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| InChIKey | FNSAKXLEFPFZOM-UHFFFAOYSA-N |
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| PubChem CID | 84271 |
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| EC No. | 238-095-8 |
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| DTXSID | DTXSID70161990 |
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| Lokaler Name | 2,4,6-Trimethoxyanilin |
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Chemische & physikalische Eigenschaften
| XLogP | 1,2 |
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| Polarare Oberfläche (TPSA) | 53,7 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 3 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 140 |
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| Schmelzpunkt | 29-31 °C |
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| Siedepunkt | 125-127 °C(Press: 0.8 Torr) |
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| Dichte | 1.118±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | Keep in dark place,Inert atmosphere,Room temperature |
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| pKa (Säurekonstante) | 5.08±0.10(Predicted) |
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| InChI | InChI=1S/C9H13NO3/c1-11-6-4-7(12-2)9(10)8(5-6)13-3/h4-5H,10H2,1-3H3 |
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| InChIKey | FNSAKXLEFPFZOM-UHFFFAOYSA-N |
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| SMILES | C1(N)=C(OC)C=C(OC)C=C1OC |
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| CAS Datenbank | 14227-17-9 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, 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 | Acute Tox. 4 (100%) |
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| Zollcode | 2922290090 |
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| hazard_note | Harmful |
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