HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
N-(Cyclopent-1-en-1-yl)pyrrolidin
1-(Cyclopent-1-en-1-yl)pyrrolidine · Cyclopentenylpyrrolidine · 1-Pyrrolidinocyclopentene · 1-Pyrrolizinocyclopentene · 1-Cyclopentenylpyrrolidine · 1-PYRROLIDINO-1-CYCLOPENTENE · 1-PYRROLIDINE-1-CYCLOPENTENE · 1-Pyrrolizino-1-cyclopentene
Identifikatoren & physikalische Daten
| CAS No. | 7148-07-4 |
|---|---|
| Summenformel | C9H15N |
| Durchschnittliche Molmasse | 137,22 g/mol |
| Monoisotopische Masse | 137,12044948 g/mol |
| SMILES | C1=C(N2CCCC2)CCC1 |
| InChIKey | KOFSFYBXUYHNJL-UHFFFAOYSA-N |
| PubChem CID | 81570 |
| EC No. | 230-463-6 |
| DTXSID | DTXSID90884356 |
| Lokaler Name | N-(Cyclopent-1-en-1-yl)pyrrolidin |
Chemische & physikalische Eigenschaften
| XLogP | 2,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 3,2 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 143 |
| SpringerMaterials Properties | 15N nuclear magnetic resonance spectrum |
| Siedepunkt | 100-110 °C/15 mmHg (lit.) |
| Dichte | 0.941 g/mL at 25 °C (lit.) |
| Brechungsindex | n20/D 1.5155(lit.) |
| Flammpunkt | 116 °F |
| Lagerbedingungen | 2-8°C |
| Aggregatzustand | Liquid |
| pKa (Säurekonstante) | 8.90±0.20(Predicted) |
| Farbe | Clear yellow |
| BRN | 109824 |
| InChI | 1S/C9H15N/c1-2-6-9(5-1)10-7-3-4-8-10/h5H,1-4,6-8H2 |
| InChIKey | KOFSFYBXUYHNJL-UHFFFAOYSA-N |
| SMILES | C1CCN(C1)C2=CCCC2 |
| CAS Datenbank | 7148-07-4(CAS DataBase Reference) |
| NIST chemische Informationen | Pyrrolidine, 1-(1-cyclopenten-1-yl)-(7148-07-4) |
| EPA chemische Informationen | Pyrrolidine, 1-(1-cyclopenten-1-yl)- (7148-07-4) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH226 (91.3%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 46 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Status: Active Update: 10-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/22314 |
| Hazard Classes and Categories | Flam. Liq. 3 (91.3%) |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN 1993 3/PG 3 |
| Zollcode | 29339900 |
| R-Sätze (R) | 10-36/37/38-20/21/22 |
| Gefahrensymbole | Xi,Xn |
| Sicherheitshinweise (S) | 16-26-36/37/39-37/39 |
| Gefahrenklasse | 3Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3 |
| Verpackungsgruppe | III |
| Lagerklasse | 3 - Flammable liquids |
Anwendungen & Verwendung
Verwenden
1-pyrrolidino-1-cyclopentene was used in the synthesis of halichlorine, pinnaic acid, and tauropinnaic acid.