HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Indan-1-on
2,3-Dihydro-1H-inden-1-one · INDANONE · 1H-INDEN-1-ONE, 2,3-DIHYDRO- · IDO · INDO · INDAN-1-ONE · 2,3-Dihydro-1-indanone · Indone
Identifikatoren & physikalische Daten
| CAS No. | 30286-23-8 |
|---|---|
| Summenformel | C9H8O |
| Durchschnittliche Molmasse | 132,16 g/mol |
| Monoisotopische Masse | 132,05751488 g/mol |
| SMILES | O=C1CCc2ccccc21 |
| InChIKey | QNXSIUBBGPHDDE-UHFFFAOYSA-N |
| PubChem CID | 6735 |
| ChEBI | CHEBI:17404 |
| EC No. | 201-470-1 |
| DTXSID | DTXSID1058892 |
| Lokaler Name | Indan-1-on |
Chemische & physikalische Eigenschaften
| XLogP | 1,7 |
|---|---|
| Polarare Oberfläche (TPSA) | 17,1 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 151 |
| Stoffklassen | Other Classes -> Aromatic Ketones |
| SpringerMaterials Properties | Chemical shift |
| Physical Description | Off-white crystalline solid[Alfa Aesar MSDS] |
| Schmelzpunkt | 38-40 °C(lit.) |
| Siedepunkt | 243-245 °C(lit.) |
| Dichte | 1.103 g/mL at 25 °C(lit.) |
| Brechungsindex | 1.5610 (estimate) |
| Flammpunkt | 233 °F |
| Lagerbedingungen | Store below +30°C. |
| Löslichkeit | 6.5g/l6.5 g/L (20 C) |
| Aggregatzustand | Crystalline Mass |
| Farbe | Light yellow to brown |
| Geruch | Rather weak, woody and somewhat medicinal odor with an incense-like undertone. |
| Biologische Quelle | mouse |
| Geruchsschwelle | 0.0088ppm |
| BRN | 507957 |
| Stabilität | Light sensitive |
| InChI | 1S/C9H8O/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4H,5-6H2 |
| InChIKey | QNXSIUBBGPHDDE-UHFFFAOYSA-N |
| SMILES | O=C1CCc2ccccc12 |
| CAS Datenbank | 83-33-0(CAS DataBase Reference) |
| NIST chemische Informationen | 1H-Inden-1-one, 2,3-dihydro-(83-33-0) |
| EPA chemische Informationen | 1H-Inden-1-one, 2,3-dihydro- (83-33-0) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 18.2% (4 of 22) of reports.WarningH302 (72.7%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 22 reports by companies from 6 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Chemical: 1H-Inden-1-one, 2,3-dihydro-Status: Active Update: 03-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/245441H-Inden-1-one, 2,3-dihydro-: Does not have an individual approval but may be used under an appropriate group standard |
| Gefahrenübersicht | May cause irritationToxic by ingestion[Alfa Aesar MSDS] See 1-Tetralone. |
| Hazard Classes and Categories | Acute Tox. 4 (72.7%) |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 29143900 |
| R-Sätze (R) | 22-36/37/38 |
| Gefahrensymbole | Xn,Xi |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 22-24/25-36-26 |
| Lagerklasse | 11 - Combustible Solids |
| Selbstentzündungstemperatur | 525 °C |
Anwendungen & Verwendung
Beschreibung
1-Indanone is an important skeletal structure with a wide range of biological activities. Extensive research has demonstrated that 1-indanone derivatives play a significant role in the development of drugs for the treatment of Alzheimer's disease, as well as in anti-diarrhoeal, anti-proliferative, antibacterial, anti-inflammatory and anti-cancer agents[1].
Verwenden
1-Indanone is an oxidation product of Indan, a component of fuels, solvents, and varnishes. 1-Indanone is also a metabolite of Thalidomide that has been shown to inhibit the attachment of tumor cells to concanavalin A coated plastic surfaces.