HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
1-Iodheptan
Iodoheptane · Heptane, 1-iodo- · SKL1370 · 1-Jodheptan · Heptyljodid · 1-Iodohptane · HEPTYL IODIDE · I-Iodoheptane
Identifikatoren & physikalische Daten
| CAS No. | 4282-40-0 |
|---|---|
| Summenformel | C7H15I |
| Durchschnittliche Molmasse | 226,1 g/mol |
| Monoisotopische Masse | 226,02184848 g/mol |
| SMILES | CCCCCCCI |
| InChIKey | LMHCYRULPLGEEZ-UHFFFAOYSA-N |
| PubChem CID | 20274 |
| EC No. | 224-285-8 |
| DTXSID | DTXSID2063393 |
| Lokaler Name | 1-Iodheptan |
Chemische & physikalische Eigenschaften
| XLogP | 4,7 |
|---|---|
| Polarare Oberfläche (TPSA) | 0 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 0 |
| Frei drehbare Bindungen | 5 |
| Schwere Atome | 8 |
| Formalladung | 0 |
| Komplexität | 35,4 |
| Stoffklassen | Other Classes -> Halogenated Aliphatics, Saturated |
| SpringerMaterials Properties | Boiling point |
| LogP (Verteilungskoeffizient) | 4.7 |
| Physical Description | Colorless liquid[Alfa Aesar MSDS] |
| Schmelzpunkt | -48 °C (lit.) |
| Siedepunkt | 204 °C (lit.) |
| Dichte | 1.379 g/mL at 25 °C (lit.) |
| Brechungsindex | n20/D 1.490(lit.) |
| Flammpunkt | 174 °F |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| Löslichkeit | benzene: miscible(lit.)immiscible |
| Aggregatzustand | clear liquid |
| Farbe | Colorless to Brown |
| Wichte | 1.379 |
| BRN | 1697161 |
| Henry-Konstante | 2.6×10-4 mol/(m3Pa) at 25℃, Abraham (1984) |
| Dielektrizitätskonstante | 4.9(22℃) |
| InChI | 1S/C7H15I/c1-2-3-4-5-6-7-8/h2-7H2,1H3 |
| InChIKey | LMHCYRULPLGEEZ-UHFFFAOYSA-N |
| SMILES | CCCCCCCI |
| CAS Datenbank | 4282-40-0(CAS DataBase Reference) |
| NIST chemische Informationen | 1-Iodoheptane(4282-40-0) |
| EPA chemische Informationen | Heptane, 1-iodo- (4282-40-0) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (97.8%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Heptane, 1-iodo-: Does not have an individual approval but may be used under an appropriate group standard |
| Gefahrenübersicht | Intraperitoneal LD50 (mouse) = 780 mg/kg[RTECS] A skin and strong eye irritant[Alfa Aesar MSDS] See Ethyl iodide. |
| Hazard Classes and Categories | Skin Irrit. 2 (97.8%) |
| F | 8 |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 29033080 |
| RTECS-Nr. | MJ1050000 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 26-36-37/39 |
| Lagerklasse | 10 - Combustible liquids |
Anwendungen & Verwendung
Verwenden
1-Iodoheptane is used in the functionalization of symmetrical star-shaped molecules with carborane clusters.