Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
2-Vinylhexafluoroisopropanol |
EINECS | N/A |
CAS No. | 19701-19-0 | Density | 1.422 g/cm3 |
PSA | 20.23000 | LogP | 2.02810 |
Solubility | N/A | Melting Point |
N/A |
Formula | C5H4F6O | Boiling Point | 99.901 °C at 760 mmHg |
Molecular Weight | 194.077 | Flash Point | 14.22 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 20/22-34-41 |
Molecular Structure | Hazard Symbols | C | |
Synonyms |
1,1,1-Trifluoro-2-(trifluoromethyl)-3-buten-2-ol; |
Article Data | 4 |
The systematic name of 2-Vinylhexafluoroisopropanol is 1,1,1-trifluoro-2-(trifluoromethyl)but-3-en-2-ol. With the CAS registry number 19701-19-0, it is also named as 3-Buten-2-ol, 1,1,1-trifluoro-2-(trifluoromethyl)-. In addition, its molecular formula is C5H4F6O and molecular weight is 194.07.
The other characteristics of 2-Vinylhexafluoroisopropanol can be summarized as: (1)ACD/LogP: 3.42; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 9.23 Å2; (7)Index of Refraction: 1.323; (8)Molar Refractivity: 27.35 cm3; (9)Molar Volume: 136.4 cm3; (10)Polarizability: 10.84×10-24cm3; (11)Surface Tension: 17.4 dyne/cm; (12)Density: 1.421 g/cm3; (13)Flash Point: 14.2 °C; (14)Enthalpy of Vaporization: 39.55 kJ/mol; (15)Boiling Point: 99.9 °C at 760 mmHg; (16)Vapour Pressure: 21.4 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following: it is harmful by inhalation and if swallowed. It also may cause burns. Moreover, it is risk of serious damage to the eyes. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. And you should wear suitable protective clothing, gloves and eye/face protection.
People can use the following data to convert to the molecule structure.
(1)SMILES: FC(F)(F)C(O)(\C=C)C(F)(F)F
(2)InChI: InChI=1/C5H4F6O/c1-2-3(12,4(6,7)8)5(9,10)11/h2,12H,1H2
(3)InChIKey: VUSMHPJJFLCUOR-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C5H4F6O/c1-2-3(12,4(6,7)8)5(9,10)11/h2,12H,1H2
(5)Std. InChIKey: VUSMHPJJFLCUOR-UHFFFAOYSA-N