HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
9,9-Bis(4-hydroxyphenyl)fluorene
BPF · BPFL · BISPHENOLFLUORENE · FLUORENE-9-BISPHENOL · Bisphenol FL · fluorene-9-bispheno · 4,4'-(9H-fluorene-9,9-diyl)diphenol · 9,9-Bis(4-hydroxyphenyl)fluorene (purified by sublimation)
Identifikatoren & physikalische Daten
| CAS No. | 3236-71-3 |
|---|---|
| Summenformel | C25H18O2 |
| Durchschnittliche Molmasse | 350,4 g/mol |
| Monoisotopische Masse | 350,13067982 g/mol |
| SMILES | Oc1ccc(C2(c3ccc(O)cc3)c3ccccc3-c3ccccc32)cc1 |
| InChIKey | YWFPGFJLYRKYJZ-UHFFFAOYSA-N |
| PubChem CID | 76716 |
| ChEMBL | CHEMBL434829 |
| ChEBI | CHEBI:136855 |
| EC No. | 406-950-6 |
| DTXSID | DTXSID5037731 |
Chemische & physikalische Eigenschaften
| XLogP | 6 |
|---|---|
| Polarare Oberfläche (TPSA) | 40,5 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 27 |
| Formalladung | 0 |
| Komplexität | 454 |
| Endocrine Disruptors | Potential endocrine disrupting compound |
| Collision Cross Section | 194.8 Ų [M-H]- [CCS Type: DTBuffer gas: N2Ionization: ESI-Dataset: TOXCASTSource Identifier: DTXSID5037731] |
| Schmelzpunkt | 224-226 °C (lit.) |
| Siedepunkt | 526.4±50.0 °C(Predicted) |
| Dichte | 1.288±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Löslichkeit | Insoluble in water |
| pKa (Säurekonstante) | 9.58±0.30(Predicted) |
| Aggregatzustand | solid |
| Farbe | White to Almost white |
| BRN | 2060986 |
| Henry-Konstante | 8.4×108 mol/(m3Pa) at 25℃, Zhang et al. (2010) |
| InChI | InChI=1S/C25H18O2/c26-19-13-9-17(10-14-19)25(18-11-15-20(27)16-12-18)23-7-3-1-5-21(23)22-6-2-4-8-24(22)25/h1-16,26-27H |
| InChIKey | YWFPGFJLYRKYJZ-UHFFFAOYSA-N |
| SMILES | C1(C2=CC=C(O)C=C2)(C2=CC=C(O)C=C2)C2=C(C=CC=C2)C2=C1C=CC=C2 |
| CAS Datenbank | 3236-71-3(CAS DataBase Reference) |
| EPA chemische Informationen | Phenol, 4,4'-(9H-fluoren-9-ylidene)bis- (3236-71-3) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315: Causes skin irritation [Warning Skin corrosion/irritation]P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
|---|---|
| Regulatorische Informationen | PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.Status: Active Update: 15-12-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/14010 |
| Hazard Classes and Categories | Skin Irrit. 2 (100%)Eye irritation - category 2 |
| Wassergefährdungsklasse (WGK) | 2 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN 3077 9/PG 3 |
| Zollcode | 38220000 |
| R-Sätze (R) | 36/38-50/53-36/37/38 |
| Gefahrensymbole | Xi,N |
| Sicherheitshinweise (S) | 26-37-60-61-37/39 |
| Gefahrenklasse | IRRITANTAquatic Acute 1Aquatic Chronic 1Eye Irrit. 2Skin Irrit. 2 |
| Verpackungsgruppe | III |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
9,9-Bis (4-Hydroxyphenyl) Fluorene is used in the production of polyarylene ethers and extensively used in the study of polymer electrolyte membranes with the potential for fuel cell application.