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CAS No.: | 186589-89-9 |
---|---|
Name: | 2-Fluoro-5-iodophenol |
Molecular Structure: | |
Formula: | C6H4FIO |
Molecular Weight: | 238.00 |
Synonyms: | C6H4FIO |
Density: | 2.085 g/cm3 |
Boiling Point: | 248.954 °C at 760 mmHg |
Flash Point: | 104.364 °C |
PSA: | 20.23000 |
LogP: | 2.13590 |
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This chemical is called 2-Fluoro-5-iodophenol, and its CAS registry number is 186589-89-9. With the molecular formula of C6H4FIO, its molecular weight is 238.00.
Other characteristics of the 2-Fluoro-5-iodophenol can be summarised as followings: (1)ACD/LogP: 3.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.116; (4)ACD/LogD (pH 7.4): 2.988; (5)ACD/BCF (pH 5.5): 137.278; (6)ACD/BCF (pH 7.4): 102.229; (7)ACD/KOC (pH 5.5): 1178.046; (8)ACD/KOC (pH 7.4): 877.275; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 20.23 Å2; (13)Index of Refraction: 1.638; (14)Molar Refractivity: 41.035 cm3; (15)Molar Volume: 114.146 cm3; (16)Polarizability: 16.268×10-24cm3; (17)Surface Tension: 50.989 dyne/cm; (18)Density: 2.085 g/cm3; (19)Flash Point: 104.364 °C; (20)Enthalpy of Vaporization: 50.584 kJ/mol; (21)Boiling Point: 248.954 °C at 760 mmHg; (22)Vapour Pressure: 0.015 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: c1cc(c(cc1I)O)F
2.InChI: InChI=1/C6H4FIO/c7-5-2-1-4(8)3-6(5)9/h1-3,9H
3.InChIKey: JDGBFLDXIZQLLT-UHFFFAOYAG