- InChI
- InChI=1S/C3H8N2S/c1-5(2)3(4)6/h1-2H3,(H2,4,6)
- InChI Key
- ZQGWBPQBZHMUFG-UHFFFAOYSA-N
- Formula
- C3H8N2S
- SMILES
- CN(C)C(N)=S
- Molecular Weight1
- 104.17
- CAS
- 6972-05-0
- Other Names
-
- Urea, 1,1-dimethyl-2-thio-
- N,N-Dimethylthiourea
- 1,1-Dimethylthiourea
- 1,1-dimethyl-2-thiourea
- 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 | 0.4368 | Relay (1.0) Calculated Property | |
| ΔfG° | 268.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 2.84 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.20 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.34 ± 0.05 | eV | NIST |
| log10WS | -1.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | -0.208 | Crippen Calculated Property | |
| McVol | 85.140 | ml/mol | McGowan Calculated Property |
| Pc | 5414.53 | kPa | Joback Calculated Property |
| Tboil | 491.39 | K | Relay (1.0) Calculated Property |
| Tc | 690.15 | K | Relay (1.0) Calculated Property |
| Tfus | 392.96 | K | Relay (1.0) Calculated Property |
| Vc | 0.306 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [157.48; 199.71] | J/mol×K | [423.05; 636.07] | 
|
| Cp,gas | 157.48 | J/mol×K | 423.05 | Joback Calculated Property |
| Cp,gas | 165.99 | J/mol×K | 458.55 | Joback Calculated Property |
| Cp,gas | 173.86 | J/mol×K | 494.06 | Joback Calculated Property |
| Cp,gas | 181.11 | J/mol×K | 529.56 | Joback Calculated Property |
| Cp,gas | 187.80 | J/mol×K | 565.07 | Joback Calculated Property |
| Cp,gas | 193.99 | J/mol×K | 600.57 | Joback Calculated Property |
| Cp,gas | 199.71 | J/mol×K | 636.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Thiourea, N,N-dimethyl-.
Sources
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