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CAS No.: | 26103-07-1 |
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Name: | Chloromethyl-1,1,1,3,3,3-hexafluoroisopropyl ether |
Article Data: | 17 |
Molecular Structure: | |
Formula: | C4H3ClF6O |
Molecular Weight: | 216.511 |
Synonyms: | Chloromethyl 1,1,1,3,3,3-hexafluoro-2-propyl ether;Chloromethyl hexafluoroisopropyl ether;Ether chloromethyl 2,2,2-trifluoro-1-(trifluoromethyl)ethyl; |
Density: | 1.488 g/cm3 |
Boiling Point: | 94.979 °C at 760 mmHg |
Flash Point: | 11.244 °C |
PSA: | 9.23000 |
LogP: | 2.69250 |
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The 1,1,1,3,3,3-Hexafluoro-2-chloromethoxypropane, with the CAS registry number 26103-07-1, is also known as Chloromethyl 1,1,1,3,3,3-hexafluoro-2-propyl ether. This chemical's molecular formula is C4H3ClF6O and molecular weight is 216.51. What's more, its systematic name is 2-(Chloromethoxy)-1,1,1,3,3,3-hexafluoropropane.
Physical properties of 1,1,1,3,3,3-Hexafluoro-2-chloromethoxypropane are: (1)ACD/LogP: 2.415; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.42; (4)ACD/LogD (pH 7.4): 2.42; (5)ACD/BCF (pH 5.5): 40.33; (6)ACD/BCF (pH 7.4): 40.33; (7)ACD/KOC (pH 5.5): 490.78; (8)ACD/KOC (pH 7.4): 490.78; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.31; (14)Molar Refractivity: 28.047 cm3; (15)Molar Volume: 145.469 cm3; (16)Polarizability: 11.119×10-24cm3; (17)Surface Tension: 16.7 dyne/cm; (18)Density: 1.488 g/cm3; (19)Flash Point: 11.244 °C; (20)Enthalpy of Vaporization: 32.077 kJ/mol; (21)Boiling Point: 94.979 °C at 760 mmHg; (22)Vapour Pressure: 52.8 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)C(OCCl)C(F)(F)F
(2)Std. InChI: InChI=1S/C4H3ClF6O/c5-1-12-2(3(6,7)8)4(9,10)11/h2H,1H2
(3)Std. InChIKey: HHYFUCXZHKDNPT-UHFFFAOYSA-N