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HCID 339537Erstellt: 27. Oktober 2026
6-Amino-1,2,3,4-tetrahydronaphthalen-1-one
6-AMINO-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE · 6-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN-1-ONE · 6-Amino-1-tetralone · 6-Aminotetralin-1-one · 6-AMino-1 · 6-Aminotetralone · 6-Amino-1-tetralone>4-tetrahydronaphthalen-1-one · 6-Amino-3,4-dihydro-1(2H<
https://huagongshe.com/de/chemical/339537
Identifikatoren & physikalische Daten
| CAS No. | 3470-53-9 |
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| Summenformel | C10H11NO |
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| Durchschnittliche Molmasse | 161,2 g/mol |
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| Monoisotopische Masse | 161,08406397 g/mol |
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| SMILES | Nc1ccc2c(c1)CCCC2=O |
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| InChIKey | BEVVUJBVEXJGKM-UHFFFAOYSA-N |
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| PubChem CID | 339537 |
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| ChEBI | CHEBI:194584 |
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| EC No. | 629-055-4 |
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| DTXSID | DTXSID40320931 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,3 |
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| Polarare Oberfläche (TPSA) | 43,1 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 190 |
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| Schmelzpunkt | 130 °C |
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| Siedepunkt | 359.4±31.0 °C(Predicted) |
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| Dichte | 1.193±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | 2-8°C |
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| Löslichkeit | soluble in Methanol |
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| Aggregatzustand | powder to crystal |
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| pKa (Säurekonstante) | 2.20±0.20(Predicted) |
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| Farbe | Light yellow to Brown |
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| InChI | InChI=1S/C10H11NO/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6H,1-3,11H2 |
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| InChIKey | BEVVUJBVEXJGKM-UHFFFAOYSA-N |
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| SMILES | C1(=O)C2=C(C=C(N)C=C2)CCC1 |
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| CAS Datenbank | 3470-53-9(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH301 (97.8%): Toxic if swallowed [Danger Acute toxicity, oral]P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 45 reports by companies from 3 notifications to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Acute Tox. 3 (97.8%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| UN-Transportnummer | UN 2811 |
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| Zollcode | 2921450090 |
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| R-Sätze (R) | 20/21/22-25 |
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| Gefahrensymbole | TXn,Xi,Xn,T |
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| hazard_note | Irritant |
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| Sicherheitshinweise (S) | 22-26-36/37/39-45 |
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| Gefahrenklasse | 6.1Acute Tox. 3 Oral |
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| Lagerklasse | 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects |
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