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Cyclopentanethanol
2-Cyclopentylethan-1-ol · Cyclopentylethanol · METHYLCYCLOPENTYLCARBINOL · TIMTEC-BB SBB008459 · CYCLOPENTANEETHANOL · 2-Cyclopentanethanol · 2-Cyclopentylethanol · 2-CYCLOPENTANEETHANOL
Identifikatoren & physikalische Daten
| CAS No. | 766-00-7 |
|---|---|
| Summenformel | C7H14O |
| Durchschnittliche Molmasse | 114,19 g/mol |
| Monoisotopische Masse | 114,10446507 g/mol |
| SMILES | OCCC1CCCC1 |
| InChIKey | JEXQWCBPEWHFKC-UHFFFAOYSA-N |
| PubChem CID | 69833 |
| EC No. | 212-156-9 |
| DTXSID | DTXSID80227399 |
| Lokaler Name | Cyclopentanethanol |
Chemische & physikalische Eigenschaften
| XLogP | 2,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 20,2 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 8 |
| Formalladung | 0 |
| Komplexität | 55 |
| Siedepunkt | 78-80°C 10mm |
| Dichte | 0,92 g/cm3 |
| Brechungsindex | 1.4585 |
| Flammpunkt | 78-80°C/10mm |
| Lagerbedingungen | 2-8°C |
| Löslichkeit | Chloroform, DMSO, Methanol |
| Aggregatzustand | Oil |
| pKa (Säurekonstante) | 15.22±0.10(Predicted) |
| Farbe | Pale Yellow |
| BRN | 2069860 |
| CAS Datenbank | 766-00-7(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH227 (100%): Combustible liquid [Warning Flammable liquids]H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, 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. |
|---|---|
| Hazard Classes and Categories | Flam. Liq. 4 (100%)Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%) |
| Zollcode | 2906190090 |
| Sicherheitshinweise (S) | 23-24/25 |
Anwendungen & Verwendung
Verwenden
Cyclopentaneethanol is used in the prepartion of phenylalanine derivatives for incorporation into peptides as CD4 mimetic miniproteins interacting with HIV-1 surface glycoprotein. It is also used in the preparation of tertiary amine muscarinic receptor antagonists applied towards the treatment of chronic obstructive pulmonary disease.