tetracosafluoro-tetradecahydrophenanthrene

• ChemBase ID: 6449
• Molecular Formular: C14F24
• Molecular Mass: 624.1114768
• Monoisotopic Mass: 623.96167728
• SMILES: C12(C(C(C(C(C1(C1(C(C(C2(F)F)(F)F)(C(C(C(C1(F)F)(F)F)(F)F)(F)F)F)F)F)(F)F)(F)F)(F)F)(F)F)F
• Canonical SMILES: FC1(F)C(F)(F)C(F)(F)C(C2(C1(F)C1(F)C(F)(F)C(F)(F)C(C(C1(F)C(C2(F)F)(F)F)(F)F)(F)F)F)(F)F
• InChI: InChI=1S/C14F24/c15-1-2(16)4(18,10(29,30)14(37,38)12(33,34)6(2,21)22)8(25,26)7(23,24)3(1,17)9(27,28)13(35,36)11(31,32)5(1,19)20
• InChIKey: QKENRHXGDUPTEM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tetracosafluoro-tetradecahydrophenanthrene
• IUPAC Traditional name: perfluorophenanthrene
• Synonyms: Perfluoro(perhydrophenanthrene); Flutec PP11, Tetracosafluorotetradecahydrophenanthrene; Perfluoroperhydrophenanthrene 80%; Tetracosafluorotetradecahydrophenanthrene; Perfluoro(tetradecahydrophenanthrene), mixture of isomers; Perfluoroperhydrophenanthrene; 全氟(十四氢菲),异构体混合物

Database IDs

• CAS Number: 306-91-2
• EC Number: 400-470-0
• MDL Number: MFCD00042596
• Beilstein Number: 2514226
• PubChem SID: 160969756
• PubChem CID: 78972

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 7.4014792
• LogD (pH = 7.4): 7.4014792
• Log P: 7.4014792
• Molar Refractivity: 59.382 cm^3
• Polarizability: 24.985563 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: -20°C; -20°C
• Boiling Point: 212-218 °C; 215°C; 215°C
• Flash Point: none°C
• Density: 2.03; 2.03 g/mL at 20 °C; 2.030
• Refractive Index: 1.3348

Safety Information

• Storage Warning: Irritant
• German water hazard class: 3
• TSCA Listed: true; 是

Product Information

• Purity: 80%
• Grade: Selectophore™
• Empirical Formula (Hill Notation): C14F24

DETAILS

Sigma Aldrich - 56919

Application
Solvent for fluorous liquid phase in ion-selective electrodes
General description
Visit our Sensor Applications portal to learn more.
Legal Information
Selectophore is a trademark of Sigma-Aldrich GmbH