- InChI
- InChI=1S/C4H9NOS/c1-3-5-4(7)6-2/h3H2,1-2H3,(H,5,7)
- InChI Key
- ZYOAATWGQPZZFV-UHFFFAOYSA-N
- Formula
- C4H9NOS
- SMILES
- CCNC(=S)OC
- Molecular Weight1
- 119.19
- CAS
- 65351-53-3
- 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).
- 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 |
|---|---|---|---|
| ω | 0.3755 | Relay (1.0) Calculated Property | |
| ΔfG° | 84.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -203.70 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 17.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.86 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.23 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.85 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.527 | Crippen Calculated Property | |
| McVol | 95.120 | ml/mol | McGowan Calculated Property |
| Pc | 4362.63 | kPa | Joback Calculated Property |
| Inp | 1046.00 | NIST | |
| Tboil | 453.00 | K | Relay (1.0) Calculated Property |
| Tc | 649.24 | K | Relay (1.0) Calculated Property |
| Tfus | 286.87 | K | Relay (1.0) Calculated Property |
| Vc | 0.326 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [178.16; 223.08] | J/mol×K | [433.55; 634.57] | 
|
| Cp,gas | 178.16 | J/mol×K | 433.55 | Joback Calculated Property |
| Cp,gas | 186.72 | J/mol×K | 467.05 | Joback Calculated Property |
| Cp,gas | 194.82 | J/mol×K | 500.56 | Joback Calculated Property |
| Cp,gas | 202.49 | J/mol×K | 534.06 | Joback Calculated Property |
| Cp,gas | 209.74 | J/mol×K | 567.56 | Joback Calculated Property |
| Cp,gas | 216.59 | J/mol×K | 601.07 | Joback Calculated Property |
| Cp,gas | 223.08 | J/mol×K | 634.57 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N-Ethyl O-methyl thiocarbamate.
Sources
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