Predicted properties of the compound entered.
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Other Names and Identifiers |
| Standard InChI (User Input) | InChI=1S/C22H19N3O3S/c1-15-6-2-3-10-19(15)21(27)23-16-7-4-8-17(14-16)24-22(29)25-20(26)12-11-18-9-5-13-28-18/h2-14H,1H3,(H,23,27)(H2,24,25,26,29)/b12-11+ |
| Standard InChIKey (User Input) | InChIKey=AKRCDRKTVKPAHD-VAWYXSNFSA-N |
| Non-Standard InChI | |
| Non-Standard InChIKey | |
| Other Names and Identifiers | N-[3-[[(E)-3-furan-2-ylprop-2-enoyl]carbamothioylamino]phenyl]-2-methylbenzamide | N-[3-(3-furan-2-ylprop-2-enoylcarbamothioylamino)phenyl]-2-methylbenzamide | N-[3-[3-(2-furyl)prop-2-enoylcarbamothioylamino]phenyl]-2-methyl-benzamide | N-[3-[[(E)-3-(2-furyl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methyl-benzamide | N-[3-[[[[3-(2-furyl)-1-oxoprop-2-enyl]amino]-thioxomethyl]amino]phenyl]-2-methylbenzamide | N-[3-[[[[(E)-3-(2-furyl)-1-oxoprop-2-enyl]amino]-thioxomethyl]amino]phenyl]-2-methylbenzamide | N-[3-[[3-(2-furyl)acryloyl]thiocarbamoylamino]phenyl]-2-methyl-benzamide | N-[3-[[(E)-3-(2-furyl)acryloyl]thiocarbamoylamino]phenyl]-2-methyl-benzamide | N-[3-(3-furan-2-ylprop-2-enoylcarbamothioylamino)phenyl]-2-methyl-benzamide | N-[3-[[(E)-3-furan-2-ylprop-2-enoyl]carbamothioylamino]phenyl]-2-methyl-benzamide | ZINC04091018 |
| 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 | - | - | - |