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CAS No.: | 679-97-0 |
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Name: | 3,3,4,4-TETRAFLUORO-2-BUTANONE |
Molecular Structure: | |
Formula: | C4H4F4O |
Molecular Weight: | 144.069 |
Synonyms: | 1,1,2,2-Tetrafluoroethylmethyl ketone;3,3,4,4-Tetrafluoro-2-butanone;3,3,4,4-Tetrafluorobutan-2-one; |
Density: | 1.264 g/cm3 |
Boiling Point: | 67.7 °C at 760 mmHg |
Flash Point: | 13.1 °C |
Hazard Symbols: | Xi |
Risk Codes: | 10-36/37/38 |
Safety: | 16-26-36 |
Transport Information: | 1993 |
PSA: | 17.07000 |
LogP: | 1.47580 |
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The CAS register number of 2-Butanone,3,3,4,4-tetrafluoro- is 679-97-0. It also can be called as 3,3,4,4-Tetrafluoro-2-butanone and the systematic name about this chemical is 3,3,4,4-tetrafluorobutan-2-one. The molecular formula about this chemical is C4H4F4O and the molecular weight is 144.07.
Physical properties about 2-Butanone,3,3,4,4-tetrafluoro- are: (1)ACD/LogP: 1.07; (2)ACD/LogD (pH 5.5): 1.07; (3)ACD/LogD (pH 7.4): 1.07; (4)ACD/BCF (pH 5.5): 3.84; (5)ACD/BCF (pH 7.4): 3.84; (6)ACD/KOC (pH 5.5): 91.25; (7)ACD/KOC (pH 7.4): 91.25; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 17.07 Å2; (11)Index of Refraction: 1.298; (12)Molar Refractivity: 21.18 cm3; (13)Molar Volume: 113.8 cm3; (14)Polarizability: 8.4x10-24cm3; (15)Surface Tension: 15.7 dyne/cm; (16)Density: 1.264 g/cm3; (17)Flash Point: 13.1 °C; (18)Enthalpy of Vaporization: 30.95 kJ/mol; (19)Boiling Point: 67.7 °C at 760 mmHg; (20)Vapour Pressure: 144 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
This chemical is flammable. It is irritating to eyes, respiratory system and skin. If you want to use this chemical, wear suitable protective clothing. When you are using it, keep away from sources of ignition. In case of 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: FC(F)C(F)(F)C(=O)C
(2)InChI: InChI=1/C4H4F4O/c1-2(9)4(7,8)3(5)6/h3H,1H3
(3)InChIKey: LXHNMFBSYHBCLY-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C4H4F4O/c1-2(9)4(7,8)3(5)6/h3H,1H3
(5)Std. InChIKey: LXHNMFBSYHBCLY-UHFFFAOYSA-N