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| CAS No.: | 423-46-1 |
|---|---|
| Name: | 1H,1H-Perfluorohexan-1-ol |
| Article Data: | 5 |
| Molecular Structure: | |
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|
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| Formula: | C6H3F11O |
| Molecular Weight: | 300.072 |
| Synonyms: | 1,1-Dihydroperfluorohexanol;1H,1H-Perfluoro-1-hexanol; |
| Density: | 1.619 g/cm3 |
| Boiling Point: | 117.7 °C at 760 mmHg |
| Flash Point: | 25 °C |
| Hazard Symbols: |
 Xi
|
| Safety: | 23-24/25 |
| PSA: | 20.23000 |
| LogP: | 3.08220 |
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Specification
The 1H, 1H-Perfluorohexan-1-ol, with the CAS registry number of 423-46-1, is also known as 1H, 1H-Perfluoro-1-hexanol. This chemical's molecular formula is C6H3F11O and molecular weight is 300.07. What's more, its systematic name is called 2, 2, 3, 3, 4, 4, 5, 5, 6, 6, 6-Undecafluorohexan-1-ol.
Physical properties about 1H, 1H-Perfluorohexan-1-ol are: (1)ACD/LogP: 3.73; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.73; (4)ACD/LogD (pH 7.4): 3.73; (5)ACD/BCF (pH 5.5): 402.49; (6)ACD/BCF (pH 7.4): 402.49; (7)ACD/KOC (pH 5.5): 2547.34; (8)ACD/KOC (pH 7.4): 2547.33; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.284; (14)Molar Refractivity: 33.01 cm3; (15)Molar Volume: 185.2 cm3; (16)Surface Tension: 15.5 dyne/cm; (17)Density: 1.619 g/cm3; (18)Flash Point: 25 °C; (19)Enthalpy of Vaporization: 41.49 kJ/mol; (20)Boiling Point: 117.7 °C at 760 mmHg; (21)Vapour Pressure: 8.51 mmHg at 25 °C.
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. In addition, the vapour of this chemical can not be breathed. And you should avoid contacting with skin and eyes.
You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)(C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)CO
(2) InChI: InChI=1/C6H3F11O/c7-2(8,1-18)3(9,10)4(11,12)5(13,14)6(15,16)17/h18H,1H2
(3) InChIKey: QZFZPVVDBGXQTB-UHFFFAOYAC