- InChI
- InChI=1S/C18H36S/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-16-14-17-19-18/h18H,2-17H2,1H3
- InChI Key
- QAYAAJHVMVYEEP-UHFFFAOYSA-N
- Formula
- C18H36S
- SMILES
- CCCCCCCCCCCCCCC1CCCS1
- Molecular Weight1
- 284.54
- Other Names
-
- Thiolane, 2-tetradecyl
- 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° | 177.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -309.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.73 | kJ/mol | Joback Calculated Property |
| log10WS | -7.25 | Crippen Calculated Property | |
| logPoct/wat | 6.973 | Crippen Calculated Property | |
| McVol | 269.970 | ml/mol | McGowan Calculated Property |
| Pc | 1301.41 | kPa | Joback Calculated Property |
| Inp | [2199.00; 2200.00] |
|
|
| Inp | 2199.00 | NIST | |
| Inp | 2200.00 | NIST | |
| Inp | 2199.40 | NIST | |
| Inp | 2200.00 | NIST | |
| Inp | 2199.00 | NIST | |
| Tboil | 674.35 | K | Joback Calculated Property |
| Tc | 859.14 | K | Joback Calculated Property |
| Tfus | 386.97 | K | Joback Calculated Property |
| Vc | 1.030 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [778.27; 892.13] | J/mol×K | [674.35; 859.14] |
|
| Cp,gas | 778.27 | J/mol×K | 674.35 | Joback Calculated Property |
| Cp,gas | 799.80 | J/mol×K | 705.15 | Joback Calculated Property |
| Cp,gas | 820.25 | J/mol×K | 735.95 | Joback Calculated Property |
| Cp,gas | 839.66 | J/mol×K | 766.75 | Joback Calculated Property |
| Cp,gas | 858.09 | J/mol×K | 797.55 | Joback Calculated Property |
| Cp,gas | 875.56 | J/mol×K | 828.35 | Joback Calculated Property |
| Cp,gas | 892.13 | J/mol×K | 859.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Tetradecylthiolane.
Sources
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