- InChI
- InChI=1S/C7H5Cl2NS/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)
- InChI Key
- KGKGSIUWJCAFPX-UHFFFAOYSA-N
- Formula
- C7H5Cl2NS
- SMILES
- NC(=S)c1c(Cl)cccc1Cl
- Molecular Weight1
- 206.09
- CAS
- 1918-13-4
- Other Names
-
- 2,6-Dichlorothiobenzamide
- Benzenecarbothioamide, 2,6-dichloro-
- Benzamide, 2,6-dichlorothio-
- Chlorothiamide
- Chlorthiamide
- Chlorthioamide
- Chlortiamid
- DCBN
- 2,6-Dichlorobenzenecarbothioamide
- 2,6-Dichlor-thiobenzamid
- Prefix
- SD 7961
- WL-5792
- 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° | 260.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 174.59 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.92 | kJ/mol | Joback Calculated Property |
| log10WS | -3.61 | Crippen Calculated Property | |
| logPoct/wat | 2.628 | Crippen Calculated Property | |
| McVol | 132.240 | ml/mol | McGowan Calculated Property |
| Pc | 4362.63 | kPa | Joback Calculated Property |
| Tboil | 613.63 | K | Joback Calculated Property |
| Tc | 880.36 | K | Joback Calculated Property |
| Tfus | 397.48 | K | Joback Calculated Property |
| Vc | 0.482 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [252.45; 290.49] | J/mol×K | [613.63; 880.36] | 
|
| Cp,gas | 252.45 | J/mol×K | 613.63 | Joback Calculated Property |
| Cp,gas | 260.32 | J/mol×K | 658.09 | Joback Calculated Property |
| Cp,gas | 267.45 | J/mol×K | 702.54 | Joback Calculated Property |
| Cp,gas | 273.94 | J/mol×K | 747.00 | Joback Calculated Property |
| Cp,gas | 279.87 | J/mol×K | 791.45 | Joback Calculated Property |
| Cp,gas | 285.36 | J/mol×K | 835.91 | Joback Calculated Property |
| Cp,gas | 290.49 | J/mol×K | 880.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Chlorthiamid.
Sources
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