- InChI
- InChI=1S/C3H7NS/c1-4(2)3-5/h3H,1-2H3
- InChI Key
- SKECXRFZFFAANN-UHFFFAOYSA-N
- Formula
- C3H7NS
- SMILES
- CN(C)C=S
- Molecular Weight1
- 89.16
- CAS
- 758-16-7
- Other Names
-
- Formamide, N,N-dimethylthio-
- Dimethylthioformamide
- N,N-Dimethylthioformamide
- HCSN(CH3)2
- N,N-Dimethylmethanethioamide
- N,N-dimethylthioforamide
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- 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).
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| PAff | 906.40 | kJ/mol | NIST |
| BasG | 875.50 | kJ/mol | NIST |
| ΔfG° | 210.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 118.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 12.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 30.96 | kJ/mol | Joback Calculated Property |
| IE | [8.16; 8.20] | eV |
|
| IE | 8.16 | eV | NIST |
| IE | 8.20 | eV | NIST |
| IE | 8.20 | eV | NIST |
| log10WS | -0.50 | Crippen Calculated Property | |
| logPoct/wat | 0.505 | Crippen Calculated Property | |
| McVol | 75.160 | ml/mol | McGowan Calculated Property |
| Pc | 4952.36 | kPa | Joback Calculated Property |
| I | [1829.00; 1829.00] |
|
|
| I | 1829.00 | NIST | |
| I | 1829.00 | NIST | |
| Tboil | 350.64 | K | Joback Calculated Property |
| Tc | 542.31 | K | Joback Calculated Property |
| Tfus | 204.27 | K | Joback Calculated Property |
| Vc | 0.257 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [114.47; 154.66] | J/mol×K | [350.64; 542.31] |
|
| Cp,gas | 114.47 | J/mol×K | 350.64 | Joback Calculated Property |
| Cp,gas | 122.44 | J/mol×K | 382.58 | Joback Calculated Property |
| Cp,gas | 129.85 | J/mol×K | 414.53 | Joback Calculated Property |
| Cp,gas | 136.75 | J/mol×K | 446.47 | Joback Calculated Property |
| Cp,gas | 143.16 | J/mol×K | 478.42 | Joback Calculated Property |
| Cp,gas | 149.12 | J/mol×K | 510.36 | Joback Calculated Property |
| Cp,gas | 154.66 | J/mol×K | 542.31 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 390.00 ± 1.00 | K | 3.60 | NIST |
Similar Compounds
Find more compounds similar to Methanethioamide, N,N-dimethyl-.
Sources
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