- InChI
- InChI=1S/C5H11NS2/c1-3-4-8-5(7)6-2/h3-4H2,1-2H3,(H,6,7)
- InChI Key
- KUDJTSQPXXVPAQ-UHFFFAOYSA-N
- Formula
- C5H11NS2
- SMILES
- CCCSC(=S)NC
- Molecular Weight1
- 149.28
- 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).
- Inp : Non-polar retention indices.
- 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° | 230.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 95.31 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.71 | kJ/mol | Joback Calculated Property |
| log10WS | -2.34 | Crippen Calculated Property | |
| logPoct/wat | 1.634 | Crippen Calculated Property | |
| McVol | 119.690 | ml/mol | McGowan Calculated Property |
| Pc | 4026.13 | kPa | Joback Calculated Property |
| Inp | [1507.00; 1521.00] |
|
|
| Inp | 1507.00 | NIST | |
| Inp | 1509.00 | NIST | |
| Inp | 1512.00 | NIST | |
| Inp | 1516.00 | NIST | |
| Inp | 1518.00 | NIST | |
| Inp | 1521.00 | NIST | |
| Inp | 1507.00 | NIST | |
| Inp | 1521.00 | NIST | |
| Tboil | 502.79 | K | Joback Calculated Property |
| Tc | 725.26 | K | Joback Calculated Property |
| Tfus | 267.44 | K | Joback Calculated Property |
| Vc | 0.441 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [238.58; 291.87] | J/mol×K | [502.79; 725.26] |
|
| Cp,gas | 238.58 | J/mol×K | 502.79 | Joback Calculated Property |
| Cp,gas | 249.00 | J/mol×K | 539.87 | Joback Calculated Property |
| Cp,gas | 258.76 | J/mol×K | 576.95 | Joback Calculated Property |
| Cp,gas | 267.88 | J/mol×K | 614.03 | Joback Calculated Property |
| Cp,gas | 276.41 | J/mol×K | 651.10 | Joback Calculated Property |
| Cp,gas | 284.39 | J/mol×K | 688.18 | Joback Calculated Property |
| Cp,gas | 291.87 | J/mol×K | 725.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propyl methylaminodithiocarbamate.
Sources
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