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| CAS No.: | 884494-88-6 |
|---|---|
| Name: | 5-CHLORO-2-FLUORO-4-PICOLINE |
| Molecular Structure: | |
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|
|
| Formula: | C6H5ClFN |
| Molecular Weight: | 145.56 |
| Synonyms: | 2-Fluoro-4-methyl-5-chloropyridine; |
| Density: | 1.264g/cm3 |
| Boiling Point: | 190.4 °C at 760 mmHg |
| Flash Point: | 69 °C |
| Hazard Symbols: |
 T；  Xi
|
| Risk Codes: | 22-37/38-41 |
| Safety: | 26-39 |
| PSA: | 12.89000 |
| LogP: | 2.18250 |
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- Total:32 Page 1 of 1 1
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Specification
The Pyridine,5-chloro-2-fluoro-4-methyl-, with CAS registry number 884494-88-6, has the systematic name of 5-chloro-2-fluoro-4-methyl-pyridine. Besides this, it is also called 5-Chloro-2-fluoro-4-picoline. And the chemical formula of this chemical is C6H5ClFN.
Physical properties of Pyridine,5-chloro-2-fluoro-4-methyl-: (1)ACD/LogP: 2.09; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.09; (4)ACD/LogD (pH 7.4): 2.09; (5)#H bond acceptors: 1; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 12.89 Å2; (9)Index of Refraction: 1.503; (10)Molar Refractivity: 34.05 cm3; (11)Molar Volume: 115 cm3; (12)Polarizability: 13.5×10-24cm3; (13)Surface Tension: 36 dyne/cm; (14)Density: 1.264 g/cm3; (15)Flash Point: 69 °C; (16)Enthalpy of Vaporization: 40.91 kJ/mol; (17)Boiling Point: 190.4 °C at 760 mmHg; (18)Vapour Pressure: 0.752 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cnc(F)cc1C
(2)InChI: InChI=1/C6H5ClFN/c1-4-2-6(8)9-3-5(4)7/h2-3H,1H3
(3)InChIKey: BJWYJLJRKBPTBA-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C6H5ClFN/c1-4-2-6(8)9-3-5(4)7/h2-3H,1H3
(5)Std. InChIKey: BJWYJLJRKBPTBA-UHFFFAOYSA-N