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Predicted properties of the compound entered.

ID AAQJMTLSYWZQQC-UHFFFAOYSA-N
Formula C29H20Cl2F3N9O2
IUPAC Name 1-(2-chlorophenyl)-N-(2-{[(4-chlorophenyl)methyl]carbamoyl}-4-cyano-6-methylphenyl)-3-{[5-(trifluoromethyl)-2H-1,2,3,4-tetrazol-2-yl]methyl}-1H-pyrazole-5-carboxamide
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C29H20Cl2F3N9O2/c1-16-10-18(13-35)11-21(26(44)36-14-17-6-8-19(30)9-7-17)25(16)37-27(45)24-12-20(15-42-40-28(38-41-42)29(32,33)34)39-43(24)23-5-3-2-4-22(23)31/h2-12H,14-15H2,1H3,(H,36,44)(H,37,45)
Standard InChIKey (User Input) InChIKey=AAQJMTLSYWZQQC-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 - - -