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Methanone,(5-chloro-2-iodophenyl)(2,6-difluorophenyl)-

  • Name Methanone,(5-chloro-2-iodophenyl)(2,6-difluorophenyl)-
  • EINECSN/A
  • CAS No. 869365-97-9
  • Density1.803 g/cm3
  • PSA17.07000
  • LogP4.45380
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC13H6ClF2IO
  • Boiling Point433.54 °C at 760 mmHg
  • Molecular Weight378.544
  • Flash Point215.998 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 869365-97-9 ((5-CHLORO-2-IODOPHENYL) 2,6-DIFLUOROPHENYL METHANO)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data5

Methanone,(5-chloro-2-iodophenyl)(2,6-difluorophenyl)- Specification

The Methanone,(5-chloro-2-iodophenyl)(2,6-difluorophenyl)- is an organic compound with the formula C13H6ClF2IO. The systematic name of this chemical is (5-chloro-2-iodo-phenyl)-(2,6-difluorophenyl)methanone. With the CAS registry number 869365-97-9, the product's category is API Intermediates.

Physical properties about Methanone,(5-chloro-2-iodophenyl)(2,6-difluorophenyl)- are: (1)ACD/LogP: 4.23; (2)ACD/LogD (pH 5.5): 4.225; (3)ACD/LogD (pH 7.4): 4.225; (4)ACD/BCF (pH 5.5): 957.316; (5)ACD/BCF (pH 7.4): 957.316; (6)ACD/KOC (pH 5.5): 4736.304; (7)ACD/KOC (pH 7.4): 4736.304; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 17.07 Å2; (11)Index of Refraction: 1.621; (12)Molar Refractivity: 73.835 cm3; (13)Molar Volume: 209.991 cm3; (14)Polarizability: 29.271×10-24cm3; (15)Surface Tension: 47.968 dyne/cm; (16)Density: 1.803 g/cm3; (17)Flash Point: 215.998 °C; (18)Enthalpy of Vaporization: 68.951 kJ/mol; (19)Boiling Point: 433.54 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(c(c(c1)F)C(=O)c2cc(ccc2I)Cl)F
(2)InChI: InChI=1/C13H6ClF2IO/c14-7-4-5-11(17)8(6-7)13(18)12-9(15)2-1-3-10(12)16/h1-6H
(3)InChIKey: MVEWMRFXBCKZMY-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C13H6ClF2IO/c14-7-4-5-11(17)8(6-7)13(18)12-9(15)2-1-3-10(12)16/h1-6H
(5)Std. InChIKey: MVEWMRFXBCKZMY-UHFFFAOYSA-N

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