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Bromcyclohexan
CYCLOHEXYL BROMIDE · Cyclohexylbromid · 1-Bromocyclohexane · Bromocylohexane · BROMOCYCLOHEXANE · bromo-cyclohexan · BroMocyclohexance · Cyclohexane,bromo-
Identifikatoren & physikalische Daten
| CAS No. | 108-85-0 |
|---|---|
| Summenformel | C6H11Br |
| Durchschnittliche Molmasse | 163,06 g/mol |
| Monoisotopische Masse | 162,00441 g/mol |
| SMILES | BrC1CCCCC1 |
| InChIKey | AQNQQHJNRPDOQV-UHFFFAOYSA-N |
| PubChem CID | 7960 |
| EC No. | 203-622-2 |
| DTXSID | DTXSID1044148 |
| Lokaler Name | Bromcyclohexan |
Chemische & physikalische Eigenschaften
| XLogP | 3,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 0 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 0 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 7 |
| Formalladung | 0 |
| Komplexität | 46 |
| Dampfdruck | 3.62 [mmHg] |
| Physical Description | Liquid with a penetrating odor[Merck Index] Colorless liquid with an unpleasant odor[Acros Organics MSDS] |
| Kovats Retention Index | 9691023970.2975984100913031288 |
| Schmelzpunkt | -57°C |
| Siedepunkt | 166-167 °C (lit.) |
| Dichte | 1.324 g/mL at 25 °C (lit.) |
| Dampfdichte | 5.62 (vs air) |
| Brechungsindex | n20/D 1.495(lit.) |
| Flammpunkt | 145 °F |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Löslichkeit | Miscible with ethanol, ether, acetone, benzene and carbon tetrachloride.insoluble |
| Aggregatzustand | Liquid |
| Wichte | approximate 1.33 (20℃) |
| Farbe | Clear colorless to light yellow |
| Geruch | Unpleasant Odor |
| Merck | 14,2730 |
| BRN | 1098373 |
| Henry-Konstante | 7.0×10-3 mol/(m3Pa) at 25℃, Hilal et al. (2008) |
| Dielektrizitätskonstante | 7.9(25℃) |
| Stabilität | Stable. Combustible. Incompatible with strong oxidizing agents, strong bases. |
| InChI | 1S/C6H11Br/c7-6-4-2-1-3-5-6/h6H,1-5H2 |
| InChIKey | AQNQQHJNRPDOQV-UHFFFAOYSA-N |
| SMILES | BrC1CCCCC1 |
| CAS Datenbank | 108-85-0(CAS DataBase Reference) |
| NIST chemische Informationen | Cyclohexane, bromo-(108-85-0) |
| EPA chemische Informationen | Cyclohexane, bromo- (108-85-0) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 22.2% (2 of 9) of reports.WarningH227 (11.1%): Combustible liquid [Warning Flammable liquids]H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (66.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]H411 (22.2%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P210, P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 9 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Reported as not meeting GHS hazard criteria per 2 of 9 reports by companies.There are 4 notifications provided by 7 of 9 reports by companies with hazard statement code(s).Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| Regulatorische Informationen | Chemical: Cyclohexane, bromo-Status: Active Update: 06-06-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/17906Cyclohexane, bromo-: Does not have an individual approval but may be used under an appropriate group standard |
| Gefahrenübersicht | May cause irritation[Acros Organics MSDS] See Chlorocyclohexane. See 1-Bromohexane. |
| Hazard Classes and Categories | Flam. Liq. 4 (11.1%)Skin Irrit. 2 (66.7%)Eye Irrit. 2A (66.7%)STOT SE 3 (66.7%)Aquatic Chronic 2 (22.2%) |
| F | 8 |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 29035990 |
| RTECS-Nr. | GU7171700 |
| R-Sätze (R) | 36/37/38-20-18-52 |
| Gefahrensymbole | Xn |
| Sicherheitshinweise (S) | 23-24/25-37/39-26 |
| Lagerklasse | 10 - Combustible liquids |
| Gefahrenklasse | Aquatic Chronic 2 |
Anwendungen & Verwendung
Verwenden
Bromocyclohexane has been used to study the ionization of equatorial and axial conformational isomers of the chair-bromocyclohexane using vacuum ultraviolet mass-analyzed threshold ionization spectroscopy.
Herstellung & Synthese
synthetische
Bromocyclohexane is synthesized by the reaction of cycloethanol and hydrobromic acid.