- InChI
- InChI=1S/C14H8Cl2O2S2/c15-9-1-5-11(6-2-9)19-13(17)14(18)20-12-7-3-10(16)4-8-12/h1-8H
- InChI Key
- NDEFWMFSVXHDCR-UHFFFAOYSA-N
- Formula
- C14H8Cl2O2S2
- SMILES
-
O=C(Sc1ccc(Cl)cc1)C(=O)Sc1ccc(
Cl)cc1 - Molecular Weight1
- 343.25
- CAS
- 24455-25-2
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.5374 | Relay (1.0) Calculated Property | |
| ΔfG° | 57.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -122.39 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.94 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.39 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.68 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.931 | Crippen Calculated Property | |
| McVol | 220.920 | ml/mol | McGowan Calculated Property |
| Pc | 2940.89 | kPa | Joback Calculated Property |
| Tboil | 650.22 | K | Relay (1.0) Calculated Property |
| Tc | 912.81 | K | Relay (1.0) Calculated Property |
| Tfus | 413.75 | K | Relay (1.0) Calculated Property |
| Vc | 0.738 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [530.97; 561.12] | J/mol×K | [903.20; 1188.84] | 
|
| Cp,gas | 530.97 | J/mol×K | 903.20 | Joback Calculated Property |
| Cp,gas | 539.18 | J/mol×K | 950.81 | Joback Calculated Property |
| Cp,gas | 546.02 | J/mol×K | 998.41 | Joback Calculated Property |
| Cp,gas | 551.58 | J/mol×K | 1046.02 | Joback Calculated Property |
| Cp,gas | 555.90 | J/mol×K | 1093.63 | Joback Calculated Property |
| Cp,gas | 559.06 | J/mol×K | 1141.23 | Joback Calculated Property |
| Cp,gas | 561.12 | J/mol×K | 1188.84 | Joback Calculated Property |
Similar Compounds
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6mF1eO1HWYcovEj9z5nalsqqz81Bz86bQ0FJ394X0HFer1dbX15vWOr127RqPx1u+fLmdllWin623QTm4qdyZoRiN+qam5/r7z/H5S8PDRXa6bJXL5RUVFWKxWCwWV1RU1NXVWSyMweFw2Gx2YWFhbGysPQqgk60bCI5vip/dAYDFYgcHn2hu3hoQ8H9U1lWqusHBy1ptB5c728vraTe3kAf9TINBV1NTRy3ETq3Ibr0cZEREhOkZ88jIyIyMjE8++WTt2rWlpaULFiyYtG+PCbm5uRqNJjEx0bmyDiSc3S10dX169+7/uro+4uYWrNG0arV3IyN7WKwx+hh6/YBSWaFSVSuVVQqFqK+v7vHHe81nX3p5eS1evNi03OmyZcss3khBPSRx/vz58PDw4uJiHx8fu3x7tIiLiysuLs7JyXGiEXcKWXE3GIbFYl9f3+eDgj6nzvQ6XReH42e1o1GtblEqJQqFRKmUKJUStbrllzuw0tIe9/LyMy13Op4rtsHBwbi4uIqKivj4+O+//5565aLTsXUDwSlM/c6MObW6yWhUe3rGm3rwVNaNRq1KVa9QiBQKkUpVrVCIdbpu8y9ksbhubiHTpkXz+dHu7kI+P+ry5ZkPenRPT88LFy489thjRUVFf/jDH44fPz4p3xTNbN1AcApkxd3VdZ6Li7tc/i6Pt5jHW2La3tt74vbtF833ZLN9eLwIPj+az4/m8YQ83iIWaxImuAYGBn7zzTfx8fGZmZlhYWF/+tOfHv4zaXby5ElwqokD5sjqzABAT0/2nTuvGQzD06b9j6/vNl/f511ceEplZUvLVh4vkseL5POjeLxILteO9zjz8/M3b94MAHl5edTbT52FRCKJiory8/Nra2tzykFVxqYeM0enG+juzqqvTygrg5qaFQaDmv4a9u/fDwA8Ho/m1fYeEvXn6LXXXmO6kAkiMe4mXV1Hy8qgr+8sI0d/9dVXAWD27Nn2Xn1pshgMhqCgIAAoKSlhupYJmsqTCMbk7Z0EAFqtnJGjf/jhhwkJCXK5/Nlnn+3v72ekhgdSVFQkk8mCgoJiYmKYrmWCyIq7Xj8wMHDZaNQDAICxu/s4APD5Sxkphsvlnj17dtGiRdXV1Vu2bLG4C+uAqHn5KSkpNCwXZSdkXaoODl5paFjDZnu6uYVotXKNRubvv2vOnH8yWFJLS0tMTExnZ+fLL7985MgRBisZnUajCQgI6OnpkUqlQqGQ6XImiuneFN202p6+vq86Og52dR1TKKRMl2M0Go3//e9/qVuwH3zwAdO12PTVV18BwNKlS5ku5KEQF3fHdPr0aRaL5eLi8vXXXzNdy8iokdN//OMfTBfyUMjqzDiyd955Jz093cPD4/r16zS/bYZa8k0ikcTFxVEv0rAwMDAwe/ZstVotk8nmzJlDZ22Ti6y7qo5sz549jY2N//rXv6iVp+yaqvv370ulUtN0fJFIRK0a9MEHH4wY9/z8fKVS+atf/cqpsw4Yd8fBYrGOHTvW2tp69erVtWvXTuLKU3q9vqGhwTRXWSKRtLe3m+/AZrPDwsIiIyNtzUx20oc5rGFnxrH09vbGxsbW19evWbOmoKBgYu9vGRwcrK+vNy1pKBaLh4eHzXfw9PRcuHChaUnDpUuXTps2zdanyeXyOXPmsNnse/fuWS9S4Fzw7O5YZsyY8d1338XExFy4cGH37t3//Oe4Bknb29vNeya1tbUWb0IWCASmufjR0dHh4eEWS8eMIjc3l1qzwNmzDkDeQKRTuHbt2jhXntq6davFsqwA4ObmtmzZspdeeunQoUOFhYUPuYjf8uXLAeDMmTMP8yEOAjszDio3Nzc5OZkamkxKSrK127p16woKCqZPny4UCk2LLS9atGiy3sfb2NgYEhLi5eUll8st1rh1Rhh3x7V3796MjAxPT88ffvhhyZIlI+7T1NTE5/MFAsFkHdTiHQrXr183Go0bN27MzMycrEMwCOPuuIxGY2pqak5OTlBQ0I8//min14zJ5XLzZ8zr6+stZu+kp6fv3LnT19fXHkenGcbdoalUqqeeeqqkpCQ6OrqoqGiU8ZNx0ul0d+7cMQ3aiESie/fume/AZrODgoJMF7VCodDp3ks8Coy7o+vu7o6NjW1sbNy4cePp06fHP6JCGRgYqKioMA3a3Lp1S6H4xVuRx3yHwlSCcXcCtbW1K1eu7Ovr+/Of//zuu++OvrPFoGRNTY3Fj1ggEFCnbSrfDzQo6eww7s6hqKjomWee0Wg0n3322Y4dO0zbTVeWVMTFYnF39y/eocDlckNCQkw9k6ioqJkzH/gdClMGxt1pZGZmbtu2jcvlvv322y4uLtTb+err6/V6vfluAoHA/O1lCxcudJalNWiAcXcmaWlp1H1WU8Q5HM68efNMV5bLly+fxEHJqQfj7kwMBkNZWdnhw4e9vb2pU7hQKHSOFR4dA8YdEYSUS3KEAOOOiIJxRwTBuCOCYNwRQTDuiCAYd0QQjDsiCMYdEQTjjgiCcUcEwbgjgmDcEUEw7oggGHdEEIw7IgjGHREE444IgnFHBMG4I4Jg3BFBMO6IIBh3RBCMOyIIxh0RBOOOCIJxRwTBuCOCYNwRQTDuiCAYd0QQjDsiCMYdEQTjjgiCcUcEwbgjgmDcEUEw7oggGHdEEIw7IgjGHREE444IgnFHBMG4I4Jg3BFBMO6IIBh3RBCMOyIIxh0RBOOOCIJxRwTBuCOCYNwRQTDuiCAYd0QQjDsiCMYdEQTjjgiCcUcEwbgjgmDcEUEw7oggGHdEEIw7IgjGHREE444IgnFHBMG4I4Jg3BFBMO6IIBh3RBCMOyIIxh0RBOOOCIJxRwTBuCOCYNwRQTDuiCAYd0QQjDsiCMYdEQTjjgiCcUcEwbgjgmDcEUEw7oggGHdEkP8H5GOfvjK/fysAAAAASUVORK5CYII=)
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