HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
1,2-Epoxyhexan
1-HEXENE OXIDE · 2-Butyloxirane · BUTYLOXIRAN · BUTYLOXIRANE · HEXYLENEOXIDE · 1,2-EPOXYHEXAN · Epoxy-n-hexane · Hexene epoxide
Identifikatoren & physikalische Daten
| CAS No. | 1436-34-6 |
|---|---|
| Summenformel | C6H12O |
| Durchschnittliche Molmasse | 100,16 g/mol |
| Monoisotopische Masse | 100,088815 g/mol |
| SMILES | CCCCC1CO1 |
| InChIKey | WHNBDXQTMPYBAT-UHFFFAOYSA-N |
| PubChem CID | 15036 |
| EC No. | 215-864-6 |
| DTXSID | DTXSID10870872 |
| Lokaler Name | 1,2-Epoxyhexan |
Chemische & physikalische Eigenschaften
| XLogP | 1,9 |
|---|---|
| Polarare Oberfläche (TPSA) | 12,5 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 7 |
| Formalladung | 0 |
| Komplexität | 52,1 |
| LogP (Verteilungskoeffizient) | 1.95 |
| Schmelzpunkt | 94°C |
| Siedepunkt | 118-120 °C(lit.) |
| Dichte | 0.833 g/mL at 20 °C(lit.) |
| Brechungsindex | n20/D 1.406 |
| Flammpunkt | 60 °F |
| Lagerbedingungen | 2-8°C |
| Löslichkeit | Difficult to mix. |
| Aggregatzustand | Liquid |
| Wichte | 0.831 |
| Farbe | Clear colorless |
| BRN | 102568 |
| InChI | InChI=1S/C6H12O/c1-2-3-4-6-5-7-6/h6H,2-5H2,1H3 |
| InChIKey | WHNBDXQTMPYBAT-UHFFFAOYSA-N |
| SMILES | O1CC1CCCC |
| LogP (Verteilungskoeffizient) | 1.950 |
| CAS Datenbank | 1436-34-6(CAS DataBase Reference) |
| EPA chemische Informationen | Oxirane, butyl- (1436-34-6) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P330, 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 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.WarningH302: Harmful if swallowed [Warning Acute toxicity, oral] |
|---|---|
| Regulatorische Informationen | Chemical: Oxirane, butyl- |
| Weitere Sicherheitsinformationen | IMAP assessments - Short-chain alkyl oxiranes: Human health tier II assessment |
| Hazard Classes and Categories | Flam. Liq. 2 (100%)Acute toxicity - category 4 |
| F | 10-21 |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN 1993 3/PG 2 |
| Zollcode | 29109000 |
| RTECS-Nr. | MO3630000 |
| R-Sätze (R) | 11-22-36/37/38 |
| Gefahrensymbole | F,Xn |
| Sicherheitshinweise (S) | 26 |
| Gefahrenklasse | 3Acute Tox. 4 OralEye Irrit. 2Flam. Liq. 2Skin Irrit. 2STOT SE 3 |
| Verpackungsgruppe | III |
| Lagerklasse | 3 - Flammable liquids |
Anwendungen & Verwendung
Verwenden
1,2-Epoxyhexane is used as chemical reagent, organic intermediates, fine chemicals, pharmaceutical research and development.