- InChI
- InChI=1S/C17H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-15-19-17(18)16-13-14-16/h16H,2-10,13-15H2,1H3
- InChI Key
- OSELOIIYMCUZBT-UHFFFAOYSA-N
- Formula
- C17H28O2
- SMILES
- CCCCCCCCCCC#CCOC(=O)C1CC1
- Molecular Weight1
- 264.40
- 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° | 121.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -293.91 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.83 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.66 | kJ/mol | Joback Calculated Property |
| log10WS | -5.25 | Crippen Calculated Property | |
| logPoct/wat | 4.474 | Crippen Calculated Property | |
| McVol | 238.370 | ml/mol | McGowan Calculated Property |
| Pc | 1582.23 | kPa | Joback Calculated Property |
| Inp | [1961.00; 1961.00] |
|
|
| Inp | 1961.00 | NIST | |
| Inp | 1961.00 | NIST | |
| Inp | 1961.00 | NIST | |
| Tboil | 680.39 | K | Joback Calculated Property |
| Tc | 870.83 | K | Joback Calculated Property |
| Tfus | 477.55 | K | Joback Calculated Property |
| Vc | 0.930 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [676.13; 772.58] | J/mol×K | [680.39; 870.83] |
|
| Cp,gas | 676.13 | J/mol×K | 680.39 | Joback Calculated Property |
| Cp,gas | 694.39 | J/mol×K | 712.13 | Joback Calculated Property |
| Cp,gas | 711.73 | J/mol×K | 743.87 | Joback Calculated Property |
| Cp,gas | 728.17 | J/mol×K | 775.61 | Joback Calculated Property |
| Cp,gas | 743.77 | J/mol×K | 807.35 | Joback Calculated Property |
| Cp,gas | 758.56 | J/mol×K | 839.09 | Joback Calculated Property |
| Cp,gas | 772.58 | J/mol×K | 870.83 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopropanecarboxyllic acid, tridec-2-ynyl ester.
Sources
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