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CAS No.: | 102488-47-1 |
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Name: | 1H,1H,2H,2H-PERFLUOROOCTYLDIMETHYLCHLOROSILANE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C10H10ClF13Si |
Molecular Weight: | 440.707 |
Synonyms: | Chlorodimethyl[2-(perfluorohexyl)ethyl]silane;(1,1,2,2-tetrahydroperfluorooctyl)dimethylchlorosilane;(Perfluorohexylethyl)dimethylchlorosilane;(Tridecafluoro-1,1,2,2-tetrahydrooctyl)dimethylchlorosilane;Chlorodimethyl(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silane;[2-(Perfluorohexyl)ethyl]dimethylchlorosilane;[2-(Tridecafluorohexyl)ethyl]dimethylchlorosilane; |
EINECS: | -0 |
Density: | 1.413 g/cm3 |
Boiling Point: | 213.021 °C at 760 mmHg |
Flash Point: | 82.633 °C |
Solubility: | Soluble in water. |
Appearance: | colorless to yellow liquid |
Hazard Symbols: | C,F |
Risk Codes: | 10-34 |
Safety: | 16-26-36/37/39 |
Transport Information: | UN 2986 |
PSA: | 0.00000 |
LogP: | 6.55920 |
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The Silane,chlorodimethyl(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-, with the CAS registry number 102488-47-1, is also known as 1H,1H,2H,2H-Perfluorooctyldimethylchlorosilane. This chemical's molecular formula is C10H10ClF13Si and molecular weight is 440.7. Its IUPAC name is called chloro-dimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silane.
Physical properties of Silane,chlorodimethyl(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-: (1)ACD/LogP: 7.54; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.54; (4)ACD/LogD (pH 7.4): 7.54; (5)ACD/BCF (pH 5.5): 316625.22; (6)ACD/BCF (pH 7.4): 316625.22; (7)ACD/KOC (pH 5.5): 301206.41; (8)ACD/KOC (pH 7.4): 301206.41; (9)#Freely Rotating Bonds: 7; (10)Index of Refraction: 1.331; (11)Molar Refractivity: 63.86 cm3; (12)Molar Volume: 311.8 cm3; (13)Surface Tension: 15.8 dyne/cm; (14)Density: 1.413 g/cm3; (15)Flash Point: 82.6 °C; (16)Enthalpy of Vaporization: 43.1 kJ/mol; (17)Boiling Point: 213 °C at 760 mmHg; (18)Vapour Pressure: 0.245 mmHg at 25°C.
Preparation: this chemical can be prepared by chloro-dimethyl-silane and 1H,1H,2H-tridecafluoro-oct-1-ene. This reaction will need solvent propan-2-ol. The reaction time is 14 hours with reaction temperature of 130 °C. The yield is about 63%.
Uses of Silane,chlorodimethyl(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-: it can be used to produce dimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-octyl)-silanol. This reaction will need reagent H2O, (NH4)2CO3, NaCl and solvent diethyl ether. The yield is about 70%.
When you are using this chemical, please be cautious about it as the following:
This chemical may destroy living tissue on contact. It may also cause burns. 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, gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C[Si](C)(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Cl
(2)InChI: InChI=1S/C10H10ClF13Si/c1-25(2,11)4-3-5(12,13)6(14,15)7(16,17)8(18,19)9(20,21)10(22,23)24/h3-4H2,1-2H3
(3)InChIKey: AKYGPHVLITVSJE-UHFFFAOYSA-N