Identifikatoren & physikalische Daten
| CAS No. | 19016-95-6 |
|---|
| Summenformel | C12.H16 |
|---|
| Durchschnittliche Molmasse | 160,25 g/mol |
|---|
| Monoisotopische Masse | 160,12520051 g/mol |
|---|
| SMILES | c1ccc(C2CCCCC2)cc1 |
|---|
| InChIKey | IGARGHRYKHJQSM-UHFFFAOYSA-N |
|---|
| PubChem CID | 13229 |
|---|
| ChEMBL | CHEMBL3278514 |
|---|
| EC No. | 212-572-0 |
|---|
| DTXSID | DTXSID3061188 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 4,9 |
|---|
| Polarare Oberfläche (TPSA) | 0 |
|---|
| H-Brücken-Donoren | 0 |
|---|
| H-Brücken-Akzeptoren | 0 |
|---|
| Frei drehbare Bindungen | 1 |
|---|
| Schwere Atome | 12 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 116 |
|---|
| Stoffklassen | Other Classes -> Aromatic Hydrocarbons |
|---|
| SpringerMaterials Properties | Boiling point |
|---|
| LogP (Verteilungskoeffizient) | 5.54 |
|---|
| Dichte | 0.938 @25 °C0.982 g/cm3(Temp: 14 °C) |
|---|
| Siedepunkt | 240 °C @760 [mm Hg]240.1 °C |
|---|
| Dampfdruck | 0.03 [mmHg]1 [mm Hg] @67.5 °C |
|---|
| Physical Description | LiquidColorless liquid with a mild odor[Alfa Aesar MSDS] |
|---|
| Schmelzpunkt | 7.3 °C |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 6% (13 of 215) of reports.DangerH302 (19.1%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P264+P265, P270, P273, P280, P301+P316, P301+P317, P302+P352, P305+P351+P338, P321, P330, P331, P332+P317, P337+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 215 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|
| Regulatorische Informationen | Benzene, cyclohexyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzene, cyclohexyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Status: Active Update: 24-08-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/5362Benzene, cyclohexyl-: Does not have an individual approval but may be used under an appropriate group standard |
|---|
| Gefahrenübersicht | A severe skin irritantCauses somnolence and effects on food intake in dermal lethal-dose studies of rabbits[RTECS] A skin and strong eye irritant[Alfa Aesar MSDS] See Biphenyl. |
|---|
| DOT Hazard Classification | PhenylcyclohexaneMarine pollutant |
|---|
| Hazard Classes and Categories | Acute Tox. 4 (19.1%)Skin Irrit. 2 (100%) |
|---|
| Protective Action Criteria (PAC) | 0.81 [mg/m3]8.9 [mg/m3]54 [mg/m3] |
|---|
| Alarmwort | Warnung |
|---|
| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H315 |
|---|
