Product Name

  • Name

    Ethyl (5-fluoro-2-iodophenoxy)acetate

  • EINECS
  • CAS No. 1245647-77-1
  • Density 1.682 g/cm3
  • Solubility
  • Melting Point
  • Formula C10H10FIO3
  • Boiling Point 313.116 °C at 760 mmHg
  • Molecular Weight 324.0875
  • Flash Point 143.168 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 1245647-77-1 (Ethyl (5-fluoro-2-iodophenoxy)acetate)
  • Hazard Symbols
  • Synonyms Acetic acid, 2-(5-fluoro-2-iodophenoxy)-, ethyl ester;
  • PSA
  • LogP

Ethyl (5-fluoro-2-iodophenoxy)acetate 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

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