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CAS No.: | 2192-55-4 |
---|---|
Name: | 2-Pentafluorophenoxyethanol |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C8H5F5O2 |
Molecular Weight: | 228.119 |
Synonyms: | Ethanol,2-(pentafluorophenoxy)- (7CI,8CI,9CI);1-Hydroxy-2-(pentafluorophenoxy)ethane;2-(Pentafluorophenoxy)ethanol; |
Density: | 1.549 |
Boiling Point: | 234.2 °C at 760 mmHg |
Flash Point: | 115.5 °C |
Appearance: | clear colorless to slightly yellow liquid |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 37/39-26-36 |
PSA: | 29.46000 |
LogP: | 1.75320 |
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The 2-Pentafluorophenoxyethanol, with cas registry number 2192-55-4, belongs to the following product categories: (1)Alcohols; (2)C7 to C8; (3)Oxygen Compounds. It has the systematic name of 2-(pentafluorophenoxy)ethanol. And its IUPAC name is 2-(2,3,4,5,6-pentafluorophenoxy)ethanol.
Physical properties about this chemical are: (1)ACD/LogP: 1.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.42; (4)ACD/LogD (pH 7.4): 1.42; (5)ACD/BCF (pH 5.5): 7.04; (6)ACD/BCF (pH 7.4): 7.04; (7)ACD/KOC (pH 5.5): 140.71; (8)ACD/KOC (pH 7.4): 140.71; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.439; (14)Molar Refractivity: 39.06 cm3; (15)Molar Volume: 148.4 cm3; (16)Polarizability: 15.48×10-24cm3; (17)Surface Tension: 33 dyne/cm; (18)Enthalpy of Vaporization: 49.77 kJ/mol; (19)Vapour Pressure: 0.0297 mmHg at 25°C.
Uses of p-Chloropropiophenone: it can be used to produce trimethyl-(2-pentafluorophenyloxy-ethoxy)-silane. This reaction will need reagent sodium saccharin. The reaction time is 2 hour(s) with reaction temperature of 80-90 ℃. The yield is about 90%.
When you are using this chemical, please be cautious about it as the following:
The 2-Pentafluorophenoxyethanol irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1c(F)c(F)c(F)c(F)c1OCCO
(2)InChI: InChI=1/C8H5F5O2/c9-3-4(10)6(12)8(15-2-1-14)7(13)5(3)11/h14H,1-2H2
(3)InChIKey: NPVVUYMVRISVGK-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C8H5F5O2/c9-3-4(10)6(12)8(15-2-1-14)7(13)5(3)11/h14H,1-2H2
(5)Std. InChIKey: NPVVUYMVRISVGK-UHFFFAOYSA-N