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Tris(4-fluorophenyl)phosphine

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Name

Tris(4-fluorophenyl)phosphine

EINECS N/A
CAS No. 18437-78-0 Density 1.132g/cm3
PSA 13.59000 LogP 3.86210
Solubility Insoluble in water. Melting Point 79-83 °C(lit.)
Formula C18H12F3P Boiling Point 351.472 °C at 760 mmHg
Molecular Weight 316.262 Flash Point 166.365 °C
Transport Information N/A Appearance white to very slightly yellow crystalline powder
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 18437-78-0 (TRIS(4-FLUOROPHENYL)PHOSPHINE) Hazard Symbols IrritantXi
Synonyms

Phosphine,tris(p-fluorophenyl)- (8CI);NSC 158458;Tri-(p-fluorophenyl)phosphine;Tris(4-fluorophenyl)phosphine;Tris(p-fluorophenyl)phosphine;

Article Data 8

Tris(4-fluorophenyl)phosphine Specification

The Phosphine,tris(4-fluorophenyl)-, with the CAS registry number 18437-78-0, is also known as NSC158458. It belongs to the product categories of Ligand; Catalysis and Inorganic Chemistry; Phosphine Ligands; Phosphorus Compounds. This chemical's molecular formula is C18H12F3P and molecular weight is 316.256851. Its IUPAC name is called tris(4-fluorophenyl)phosphane. This chemical is white to light yellow crystal powder.

Physical properties of Phosphine,tris(4-fluorophenyl)-: (1)ACD/LogP: 5.85; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.85; (4)ACD/LogD (pH 7.4): 5.85; (5)ACD/BCF (pH 5.5): 16304.61; (6)ACD/BCF (pH 7.4): 16304.61; (7)ACD/KOC (pH 5.5): 36037.85; (8)ACD/KOC (pH 7.4): 36037.85; (9)#Freely Rotating Bonds: 3; (10)Flash Point: 166.4 °C; (11)Enthalpy of Vaporization: 57.26 kJ/mol; (12)Boiling Point: 351.5 °C at 760 mmHg; (13)Vapour Pressure: 8.31E-05 mmHg at 25°C.

Uses of Phosphine,tris(4-fluorophenyl)-: it can be used to produce Difluortri(p-fluorphenyl)phosphoran at temperature of 0 °C. This reaction will need reagent 10 percent IF5 and solvent acetonitrile. The yield is about 30.1%.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=CC=C1F)P(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F
(2)InChI: InChI=1S/C18H12F3P/c19-13-1-7-16(8-2-13)22(17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18/h1-12H
(3)InChIKey: GEPJPYNDFSOARB-UHFFFAOYSA-N

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