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Predicted properties of the compound entered.

ID LGPRFFLVRYKLJB-UHFFFAOYSA-N
Formula C26H22ClF6IN8O2
IUPAC Name 3-{[3,5-bis(trifluoromethyl)-1H-1,2,4-triazol-1-yl]methyl}-N-[2-(tert-butylcarbamoyl)-4-iodo-6-methylphenyl]-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C26H22ClF6IN8O2/c1-12-8-13(34)9-15(20(43)38-24(2,3)4)18(12)36-21(44)17-10-14(39-42(17)19-16(27)6-5-7-35-19)11-41-23(26(31,32)33)37-22(40-41)25(28,29)30/h5-10H,11H2,1-4H3,(H,36,44)(H,38,43)
Standard InChIKey (User Input) InChIKey=LGPRFFLVRYKLJB-UHFFFAOYSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers
Property Value Unit Accuracy
Absolute Entropy of Ideal Gas at 298.15K and 1bar - - -
Acentric Factor - - -
Critical Compressibility Factor - - -
Critical Pressure - - -
Critical Temperature - - -
Critical Volume - - -
Enthalpy of Formation for Ideal Gas at 298.15K - - -
Liquid Molar Volume at 298.15K - - -
Molecular Weight - - -
Net Standard State Enthalpy of Combustion at 298.15K - - -
Normal Boiling Point - - -
Melting Point - - -
Refractive Index - - -
Solubility Parameter at 298.15K - - -
Standard State Absolute Entropy at 298.15K and 1bar - - -
Standard State Enthalpy of Formation at 298.15K and 1bar - - -
Magnetic Susceptibility - - -
Polarizability - - -
Flash Point - - -
Parachor - - -
Lower Flammability Limit Temperature - - -
Lower Flammability Limit Volume Percent - - -
Upper Flammability Limit Temperature - - -
Upper Flammability Limit Volume Percent - - -
Liquid Density at Normal Boiling Point - - -
Heat of Vaporization at 298.15K - - -
Heat of Vaporization at Normal Boiling Point - - -
Water Solubility - - -