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CAS No.: | 359-49-9 |
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Name: | 2,3,3,3-TETRAFLUOROPROPANOIC ACID |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C3H2F4O2 |
Molecular Weight: | 146.041 |
Synonyms: | Propionicacid, 2,3,3,3-tetrafluoro- (6CI,7CI,8CI);2,3,3,3-Tetrafluoropropionic acid; |
Density: | 1.538 g/cm3 |
Melting Point: | 28.2 °C |
Boiling Point: | 124.8 °C at 760 mmHg |
Flash Point: | 29.3 °C |
Hazard Symbols: | C,Xi |
Risk Codes: | 34 |
Safety: | 26-36/37/39 |
Transport Information: | UN 3265 |
PSA: | 37.30000 |
LogP: | 0.97140 |
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The CAS registry number of Propanoic acid,2,3,3,3-tetrafluoro- is 359-49-9. This chemical is also named as 2,3,3,3-Tetrafluoropropionic acid. In addition, its molecular formula is C3H2F4O2 and molecular weight is 146.04. Its systematic name and IUPAC name are the same which is called 2,3,3,3-tetrafluoropropanoic acid.
Physical properties about Propanoic acid,2,3,3,3-tetrafluoro- are: (1)ACD/LogP: 1.61; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.07; (4)ACD/LogD (pH 7.4): -2.14; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.306; (13)Molar Refractivity: 18.09 cm3; (14)Molar Volume: 94.8 cm3; (15)Surface Tension: 21.2 dyne/cm; (16)Density: 1.538 g/cm3; (17)Flash Point: 29.3 °C; (18)Enthalpy of Vaporization: 40.02 kJ/mol; (19)Boiling Point: 124.8 °C at 760 mmHg; (20)Vapour Pressure: 7.79 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may destroy living tissue on contact and may cause burns. It may cause inflammation to the skin or other mucous membranes. 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.
You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)C(F)C(=O)O
(2)InChI: InChI=1/C3H2F4O2/c4-1(2(8)9)3(5,6)7/h1H,(H,8,9)
(3)InChIKey: GPKYZQLMEPJAGJ-UHFFFAOYAV