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Name |
3-Chloro-2,5,6-trifluoropyridine |
EINECS | -0 |
CAS No. | 2879-42-7 | Density | 1.562 g/cm3 |
PSA | 12.89000 | LogP | 2.15230 |
Solubility | Not miscible or difficult to mix in water. | Melting Point |
N/A |
Formula | C5HClF3N | Boiling Point | 151.7 °C at 760 mmHg |
Molecular Weight | 167.52 | Flash Point | 45.6 °C |
Transport Information | UN 2810 | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
3-Chloro-2,5,6-trifluoropyridine; |
Article Data | 8 |
The Pyridine, 3-chloro-2, 5, 6-trifluoro- has CAS registry number 2879-42-7. This chemical's molecular formula is C5HClF3N and molecular weight is 167.52. What's more, its IUPAC name is 3-Chloro-2, 5, 6-trifluoropyridine. In addition, it must be stored in airtight containers and placed in a dry, cool place.
Physical properties about Pyridine, 3-chloro-2, 5, 6-trifluoro- are: (1)ACD/LogP: 1.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.47; (4)ACD/LogD (pH 7.4): 1.47; (5)ACD/BCF (pH 5.5): 7.68; (6)ACD/BCF (pH 7.4): 7.68; (7)ACD/KOC (pH 5.5): 149.82; (8)ACD/KOC (pH 7.4): 149.82; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å2; (13)Index of Refraction: 1.457; (14)Molar Refractivity: 29.22 cm3; (15)Molar Volume: 107.2 cm3; (16)Polarizability: 11.58×10-24 cm3; (17)Surface Tension: 33.8 dyne/cm; (18)Density: 1.562 g/cm3; (19)Flash Point: 45.6 °C; (20)Enthalpy of Vaporization: 37.26 kJ/mol; (21)Boiling Point: 151.7 °C at 760 mmHg; (22)Vapour Pressure: 4.62 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical may cause inflammation to the skin or other mucous membranes. During using it, wear suitable protective clothing, gloves and eye/face protection. 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: Fc1c(F)nc(F)c(Cl)c1
(2) InChI: InChI=1/C5HClF3N/c6-2-1-3(7)5(9)10-4(2)8/h1H
(3) InChIKey: OROKHXKJSDPRET-UHFFFAOYAV