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| CAS No.: | 884494-49-9 |
|---|---|
| Name: | 2-CHLORO-5-FLUORO-4-IODOPYRIDINE |
| Article Data: | 6 |
| Molecular Structure: | |
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| Formula: | C5H2ClFIN |
| Molecular Weight: | 257.433 |
| Synonyms: | 2-CHLORO-5-FLUORO-4-IODOPYRIDINE |
| Density: | 2.129 g/cm3 |
| Boiling Point: | 242.223 °C at 760 mmHg |
| Flash Point: | 100.293 °C |
| Hazard Symbols: | Xn |
| Risk Codes: | 22 |
| PSA: | 12.89000 |
| LogP: | 2.47870 |
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Specification
This chemical is called Pyridine, 2-chloro-5-fluoro-4-iodo-, and its systematic name is 2-Chloro-5-fluoro-4-iodopyridine. With the molecular formula of C5H2ClFIN, its molecular weight is 257.43. The CAS registry number of this chemical is 884494-49-9.
Other characteristics of the Pyridine, 2-chloro-5-fluoro-4-iodo- can be summarised as followings: (1)ACD/LogP: 3.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.738; (4)ACD/LogD (pH 7.4): 3.738; (5)ACD/BCF (pH 5.5): 408.187; (6)ACD/BCF (pH 7.4): 408.187; (7)ACD/KOC (pH 5.5): 2573.101; (8)ACD/KOC (pH 7.4): 2573.101; (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: 1.614; (14)Molar Refractivity: 42.14 cm3; (15)Molar Volume: 120.89 cm3; (16)Polarizability: 16.705×10-24cm3; (17)Surface Tension: 49.109 dyne/cm; (18)Density: 2.129 g/cm3; (19)Flash Point: 100.293 °C; (20)Enthalpy of Vaporization: 45.978 kJ/mol; (21)Boiling Point: 242.223 °C at 760 mmHg; (22)Vapour Pressure: 0.053 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: c1c(c(cnc1Cl)F)I
2.InChI: InChI=1/C5H2ClFIN/c6-5-1-4(8)3(7)2-9-5/h1-2H
3.InChIKey: CRLPRXQOSARJCF-UHFFFAOYAH