- InChI
- InChI=1S/C5H7NOS/c1-2-4-3-6-5(8)7-4/h2,4H,1,3H2,(H,6,8)
- InChI Key
- UZQVYLOFLQICCT-UHFFFAOYSA-N
- Formula
- C5H7NOS
- SMILES
- C=CC1CN=C(S)O1
- Molecular Weight1
- 129.18
- CAS
- 13190-34-6
- Other Names
-
- DL-Goitrin
- 5-vinyloxazolidine-2-thione
- 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 | 0.3118 | Relay (1.0) Calculated Property | |
| ΔfG° | 195.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 2.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.36 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.67 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.55 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.857 | Crippen Calculated Property | |
| McVol | 94.050 | ml/mol | McGowan Calculated Property |
| Pc | 5109.34 | kPa | Joback Calculated Property |
| Tboil | 451.59 | K | Relay (1.0) Calculated Property |
| Tc | 699.32 | K | Relay (1.0) Calculated Property |
| Tfus | 338.65 | K | Relay (1.0) Calculated Property |
| Vc | 0.312 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [193.99; 256.89] | J/mol×K | [473.41; 721.13] | 
|
| Cp,gas | 193.99 | J/mol×K | 473.41 | Joback Calculated Property |
| Cp,gas | 206.32 | J/mol×K | 514.70 | Joback Calculated Property |
| Cp,gas | 217.90 | J/mol×K | 555.98 | Joback Calculated Property |
| Cp,gas | 228.74 | J/mol×K | 597.27 | Joback Calculated Property |
| Cp,gas | 238.85 | J/mol×K | 638.55 | Joback Calculated Property |
| Cp,gas | 248.23 | J/mol×K | 679.84 | Joback Calculated Property |
| Cp,gas | 256.89 | J/mol×K | 721.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Oxazolidinethione, 5-ethenyl-.
Sources
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