- InChI
- InChI=1S/C3H6S/c1-3-4-2/h3H,1H2,2H3
- InChI Key
- AMBKPYJJYUKNFI-UHFFFAOYSA-N
- Formula
- C3H6S
- SMILES
- C=CSC
- Molecular Weight1
- 74.14
- CAS
- 1822-74-8
- ω : Acentric Factor.
- 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).
- 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 | 0.1492 | Relay (1.0) Calculated Property | |
| PAff | 858.20 | kJ/mol | NIST |
| BasG | 829.30 | kJ/mol | NIST |
| ΔfG° | 95.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 45.53 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 6.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 30.17 | kJ/mol | Relay (1.0) Calculated Property |
| IE | [8.44; 8.45] | eV |
|
| IE | 8.45 | eV | NIST |
| IE | 8.44 | eV | NIST |
| IE | 8.45 | eV | NIST |
| IE | 8.45 | eV | NIST |
| log10WS | -1.16 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.493 | Crippen Calculated Property | |
| McVol | 65.180 | ml/mol | McGowan Calculated Property |
| Pc | 4775.98 | kPa | Joback Calculated Property |
| Inp | [608.00; 608.00] |
|
|
| Inp | 608.00 | NIST | |
| Inp | 608.00 | NIST | |
| Tboil | [339.75; 343.15] | K |
|
| Tboil | 342.70 | K | NIST |
| Tboil | 343.15 ± 2.00 | K | NIST |
| Tboil | 339.75 ± 0.60 | K | NIST |
| Tc | 498.88 | K | Relay (1.0) Calculated Property |
| Tfus | 133.25 | K | Relay (1.0) Calculated Property |
| Vc | 0.228 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [91.50; 124.02] | J/mol×K | [333.50; 529.43] |
|
| Cp,gas | 91.50 | J/mol×K | 333.50 | Joback Calculated Property |
| Cp,gas | 97.48 | J/mol×K | 366.15 | Joback Calculated Property |
| Cp,gas | 103.23 | J/mol×K | 398.81 | Joback Calculated Property |
| Cp,gas | 108.75 | J/mol×K | 431.46 | Joback Calculated Property |
| Cp,gas | 114.06 | J/mol×K | 464.12 | Joback Calculated Property |
| Cp,gas | 119.15 | J/mol×K | 496.77 | Joback Calculated Property |
| Cp,gas | 124.02 | J/mol×K | 529.43 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Methyl vinyl sulfide.
Sources
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