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Cyclohexylmethanol
CYCLOHEXYLMETHANOL · Cyclohexylmethyl alcohol · NSC 5288 · usafdo-49 · USAF do-49 · 2 ampules) · Hexyl Methanol · ohexanemethanoL
Identifikatoren & physikalische Daten
| CAS No. | 100-49-2 |
|---|---|
| Summenformel | C7H14O |
| Durchschnittliche Molmasse | 114,19 g/mol |
| Monoisotopische Masse | 114,10446507 g/mol |
| SMILES | OCC1CCCCC1 |
| InChIKey | VSSAZBXXNIABDN-UHFFFAOYSA-N |
| PubChem CID | 7507 |
| EC No. | 202-857-8 |
| DTXSID | DTXSID3059212 |
| Lokaler Name | Cyclohexylmethanol |
Chemische & physikalische Eigenschaften
| XLogP | 1,9 |
|---|---|
| Polarare Oberfläche (TPSA) | 20,2 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 8 |
| Formalladung | 0 |
| Komplexität | 55,4 |
| Polymers | Other Classes -> Alcohols and Polyols, Other |
| SpringerMaterials Properties | Dielectric constant |
| Physical Description | Liquid with a mild camphor odor[Merck Index] Colorless viscous liquid[Alfa Aesar MSDS] |
| Schmelzpunkt | -43°C |
| Siedepunkt | 181 °C (lit.) |
| Dichte | 0.928 g/mL at 25 °C (lit.) |
| Brechungsindex | n20/D 1.465(lit.) |
| Flammpunkt | 160 °F |
| Lagerbedingungen | Store below +30°C. |
| Löslichkeit | Soluble in Ether, Alcohols. |
| pKa (Säurekonstante) | 15.17±0.10(Predicted) |
| Aggregatzustand | Oil |
| Farbe | Colourless |
| Merck | 14,2731 |
| BRN | 773712 |
| Dielektrizitätskonstante | 9.7(60℃) |
| InChI | 1S/C7H14O/c8-6-7-4-2-1-3-5-7/h7-8H,1-6H2 |
| InChIKey | VSSAZBXXNIABDN-UHFFFAOYSA-N |
| SMILES | OCC1CCCCC1 |
| CAS Datenbank | 100-49-2(CAS DataBase Reference) |
| NIST chemische Informationen | Cyclohexanemethanol(100-49-2) |
| EPA chemische Informationen | Cyclohexanemethanol (100-49-2) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 2.6% (1 of 39) of reports.WarningH315 (97.4%): 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 39 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: CyclohexanemethanolCyclohexanemethanol: Does not have an individual approval but may be used under an appropriate group standard |
| Gefahrenübersicht | Intraperitoneal LD50 (mouse) = 250 mg/kg[RTECS] May cause irritation[Alfa Aesar MSDS] See 2-Cyclohexylethanol. |
| Hazard Classes and Categories | Skin Irrit. 2 (97.4%) |
| Wassergefährdungsklasse (WGK) | 1 |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 29061900 |
| RTECS-Nr. | GV5075000 |
| Sicherheitshinweise (S) | 23-24/25 |
| Lagerklasse | 10 - Combustible liquids |
| Selbstentzündungstemperatur | 330 °C |
Anwendungen & Verwendung
Beschreibung
Cyclohexanemethanol is a cycloalkanol compound primarily used in organic synthesis for the preparation of other heterocyclic compounds. Under the action of a CaO catalyst (pre-calcined at 300°C), cyclohexanemethanol can be employed in ester exchange reactions to produce various fine chemicals, and is also utilised in the synthesis of polyester compounds.
Verwenden
Cyclohexanemethanol used as solvents, fuels . It is also used in pharmaceuticals, plasticizers, surfactants, lubricants, ore floatation agents, hydraulic fluids, and detergents.