- InChI
- InChI=1S/C6H8N2OS2/c1-3-5(4(2)8-9)11-6(10)7-3/h9H,1-2H3,(H,7,10)/b8-4+
- InChI Key
- ZFYHJVSPWMVAQL-XBXARRHUSA-N
- Formula
- C6H8N2OS2
- SMILES
- CC(=NO)c1sc(=S)[nH]c1C
- Molecular Weight1
- 188.27
- CAS
- 89691-87-2
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 | 0.6212 | Relay (1.0) Calculated Property | |
| ΔfG° | 177.98 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 93.88 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 130.09 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.02 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.43 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.830 | Crippen Calculated Property | |
| McVol | 130.170 | ml/mol | McGowan Calculated Property |
| Pc | 5348.32 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 586.12 | K | Relay (1.0) Calculated Property |
| Tc | 867.03 | K | Relay (1.0) Calculated Property |
| Tfus | 482.17 | K | Relay (1.0) Calculated Property |
| Vc | 0.431 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Oxime of 5-acetyl-4-methyl-4-thiazoline-2-thione.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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