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| CAS No.: | 685517-71-9 |
|---|---|
| Name: | PYRIDINE, 2,6-DIFLUORO-4-IODO- |
| Article Data: | 4 |
| Molecular Structure: | |
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| Formula: | C5H2F2IN |
| Molecular Weight: | 240.979 |
| Synonyms: | 2, 6-Difluoro-4-iodopyridine; |
| Density: | 2.129 g/cm3 |
| Melting Point: | 80-82 °C(Solv: ligroine (8032-32-4)) |
| Boiling Point: | 222 °C at 760 mmHg |
| Flash Point: | 88.1 °C |
| PSA: | 12.89000 |
| LogP: | 1.96440 |
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- Total:20 Page 1 of 1 1
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Specification
The Pyridine, 2, 6-difluoro-4-iodo- has CAS registry number 685517-71-9. This chemical's molecular formula is C5H2F2IN and molecular weight is 240.974. What's more, its systematic name is 2, 6-Difluoro-4-iodopyridine.
Physical properties about Pyridine, 2, 6-difluoro-4-iodo- are: (1)ACD/LogP: 1.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.93; (4)ACD/LogD (pH 7.4): 1.93; (5)ACD/BCF (pH 5.5): 17.24; (6)ACD/BCF (pH 7.4): 17.24; (7)ACD/KOC (pH 5.5): 267.18; (8)ACD/KOC (pH 7.4): 267.18; (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: 1.572; (14)Molar Refractivity: 37.23 cm3; (15)Molar Volume: 113.1 cm3; (16)Polarizability: 14.76×10-24 cm3; (17)Surface Tension: 43.9 dyne/cm; (18)Density: 2.129 g/cm3; (19)Flash Point: 88.1 °C; (20)Enthalpy of Vaporization: 43.98 kJ/mol; (21)Boiling Point: 222 °C at 760 mmHg; (22)Vapour Pressure: 0.154 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Fc1cc(I)cc(F)n1
(2) InChI: InChI=1/C5H2F2IN/c6-4-1-3(8)2-5(7)9-4/h1-2H
(3) InChIKey: AXPNCSVJCFXRBC-UHFFFAOYAK