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| CAS No.: | 1245647-77-1 |
|---|---|
| Name: | Ethyl (5-fluoro-2-iodophenoxy)acetate |
| Molecular Structure: | |
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| Formula: | C10H10FIO3 |
| Molecular Weight: | 324.0875 |
| Synonyms: | Acetic acid, 2-(5-fluoro-2-iodophenoxy)-, ethyl ester; |
| Density: | 1.682 g/cm3 |
| Boiling Point: | 313.116 °C at 760 mmHg |
| Flash Point: | 143.168 °C |
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Specification
The Ethyl (5-fluoro-2-iodophenoxy)acetate, with the CAS registry number 1245647-77-1, is also known as Acetic acid, 2-(5-fluoro-2-iodophenoxy)-, ethyl ester. This chemical's molecular formula is C10H10FIO3 and molecular weight is 324.0875. What's more, its systematic name is Ethyl 2-(5-fluoro-2-iodo-phenoxy)acetate.
Physical properties about Ethyl (5-fluoro-2-iodophenoxy)acetate are: (1)ACD/LogP: 3.59; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.594; (4)ACD/LogD (pH 7.4): 3.594; (5)ACD/BCF (pH 5.5): 317.075; (6)ACD/BCF (pH 7.4): 317.075; (7)ACD/KOC (pH 5.5): 2147.519; (8)ACD/KOC (pH 7.4): 2147.519; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 35.53 Å2; (13)Index of Refraction: 1.551; (14)Molar Refractivity: 61.505 cm3; (15)Molar Volume: 192.721 cm3; (16)Polarizability: 24.383×10-24 cm3; (17)Surface Tension: 42.051 dyne/cm; (18)Density: 1.682 g/cm3; (19)Flash Point: 143.168 °C; (20)Enthalpy of Vaporization: 55.417 kJ/mol; (21)Boiling Point: 313.116 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: CCOC(=O)COc1cc(ccc1I)F
(2) InChI: InChI=1/C10H10FIO3/c1-2-14-10(13)6-15-9-5-7(11)3-4-8(9)12/h3-5H,2,6H2,1H3
(3) InChIKey: WRIOKNMTPVWMOY-UHFFFAOYAG