HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Cyclohexylisopropylamin
N-Isopropylcyclohexanamine · N-cyclohexyl-N-isopropylamine · Cyclohexylisopropylamine · -Isopropylcyclohexylamine · N-CYCLOHEXYLISOPROPYLAMINE · n-isopropyl-cyclohexylamin · N-Isopropylcyclohexylamine · Cyclohexylamine, N-isopropyl-
Identifikatoren & physikalische Daten
| CAS No. | 1195-42-2 |
|---|---|
| Summenformel | C9H19N |
| Durchschnittliche Molmasse | 141,25 g/mol |
| Monoisotopische Masse | 141,15174961 g/mol |
| SMILES | CC(C)NC1CCCCC1 |
| InChIKey | UYYCVBASZNFFRX-UHFFFAOYSA-N |
| PubChem CID | 62386 |
| EC No. | 214-798-5 |
| DTXSID | DTXSID40152471 |
| Lokaler Name | Cyclohexylisopropylamin |
Chemische & physikalische Eigenschaften
| XLogP | 2,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 12 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 82,7 |
| Schmelzpunkt | -79.9°C (estimate) |
| Siedepunkt | 60-65 °C12 mm Hg(lit.) |
| Dichte | 0.859 g/mL at 25 °C(lit.) |
| Brechungsindex | n20/D 1.448(lit.) |
| Flammpunkt | 93 °F |
| Lagerbedingungen | Keep in dark place,Inert atmosphere,Room temperature |
| Löslichkeit | Chloroform (Slightly), Methanol (Slightly) |
| Aggregatzustand | Liquid |
| pKa (Säurekonstante) | 11.03±0.20(Predicted) |
| Farbe | Clear colorless to light yellow |
| BRN | 2070639 |
| InChI | 1S/C9H19N/c1-8(2)10-9-6-4-3-5-7-9/h8-10H,3-7H2,1-2H3 |
| InChIKey | UYYCVBASZNFFRX-UHFFFAOYSA-N |
| SMILES | CC(C)NC1CCCCC1 |
| CAS Datenbank | 1195-42-2(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH226 (100%): 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 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Cyclohexanamine, N-(1-methylethyl)-: Does not have an individual approval but may be used under an appropriate group standard |
| Hazard Classes and Categories | Flam. Liq. 3 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN 1993 3/PG 3 |
| Zollcode | 29213000 |
| RTECS-Nr. | GX1450000 |
| R-Sätze (R) | 10-36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26-36 |
| Gefahrenklasse | 8Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3 |
| Verpackungsgruppe | II |
| Lagerklasse | 3 - Flammable liquids |
Anwendungen & Verwendung
Verwenden
N-Cyclohexylisopropylamine was used as reagent in the synthesis of 7-hydroxy cannabidiol and cannabidiol-7-oic acid.