- InChI
- InChI=1S/C16H24O3/c1-2-3-4-5-6-7-8-9-10-13-19-16(17)15-12-11-14-18-15/h9-12,14H,2-8,13H2,1H3/b10-9+
- InChI Key
- XAVQJBRHRAITNF-MDZDMXLPSA-N
- Formula
- C16H24O3
- SMILES
- CCCCCCCCC=CCOC(=O)c1ccco1
- Molecular Weight1
- 264.36
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 | 0.7740 | Relay (1.0) Calculated Property | |
| ΔfG° | -129.92 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -525.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 86.69 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.87 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.39 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.743 | Crippen Calculated Property | |
| McVol | 225.850 | ml/mol | McGowan Calculated Property |
| Pc | 1652.40 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1938.00; 1938.00] |
|
|
| Inp | 1938.00 | NIST | |
| Inp | 1938.00 | NIST | |
| Tboil | 591.91 | K | Relay (1.0) Calculated Property |
| Tc | 776.47 | K | Relay (1.0) Calculated Property |
| Tfus | 259.56 | K | Relay (1.0) Calculated Property |
| Vc | 0.852 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-Furoic acid, undec-2-enyl ester.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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