- InChI
- InChI=1S/C12H10Cl2N2O2S/c13-9-1-5-11(6-2-9)15-16-19(17,18)12-7-3-10(14)4-8-12/h1-8,15-16H
- InChI Key
- QIDCLOWSJZPMFC-UHFFFAOYSA-N
- Formula
- C12H10Cl2N2O2S
- SMILES
-
O=S(=O)(NNc1ccc(Cl)cc1)c1ccc(C
l)cc1 - Molecular Weight1
- 317.19
- CAS
- 19957-45-0
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -57.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -218.78 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.46 | kJ/mol | Joback Calculated Property |
| log10WS | -4.53 | Crippen Calculated Property | |
| logPoct/wat | 3.299 | Crippen Calculated Property | |
| McVol | 204.950 | ml/mol | McGowan Calculated Property |
| Pc | 3759.17 | kPa | Joback Calculated Property |
| Tboil | 760.26 | K | Joback Calculated Property |
| Tc | 1000.88 | K | Joback Calculated Property |
| Tfus | 506.60 | K | Joback Calculated Property |
| Vc | 0.785 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [504.00; 554.96] | J/mol×K | [760.26; 1000.88] | 
|
| Cp,gas | 504.00 | J/mol×K | 760.26 | Joback Calculated Property |
| Cp,gas | 515.32 | J/mol×K | 800.36 | Joback Calculated Property |
| Cp,gas | 525.45 | J/mol×K | 840.47 | Joback Calculated Property |
| Cp,gas | 534.44 | J/mol×K | 880.57 | Joback Calculated Property |
| Cp,gas | 542.33 | J/mol×K | 920.68 | Joback Calculated Property |
| Cp,gas | 549.15 | J/mol×K | 960.78 | Joback Calculated Property |
| Cp,gas | 554.96 | J/mol×K | 1000.88 | Joback Calculated Property |
Similar Compounds
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Sources
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