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Predicted properties of the compound entered.

ID ABNMTCTVERDINR-UHFFFAOYSA-N
Formula C24H18Cl2F3N5O
IUPAC Name 4-[5-amino-4-(3,5-dichlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]-2-methyl-N-(pyridin-3-ylmethyl)benzamide
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C24H18Cl2F3N5O/c1-13-7-18(4-5-19(13)23(35)32-12-14-3-2-6-31-11-14)34-22(30)20(21(33-34)24(27,28)29)15-8-16(25)10-17(26)9-15/h2-11H,12,30H2,1H3,(H,32,35)
Standard InChIKey (User Input) InChIKey=ABNMTCTVERDINR-UHFFFAOYSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers
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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 - - -
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13C NMR prediction -
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