- InChI
- InChI=1S/C12H20O2/c13-12-10-8-6-4-2-1-3-5-7-9-11-14-12/h5,7H,1-4,6,8-11H2/b7-5-
- InChI Key
- FZKPUQQWULXMCD-ALCCZGGFSA-N
- Formula
- C12H20O2
- SMILES
- O=C1CCCCCCCC=CCCO1
- Molecular Weight1
- 196.29
- Other Names
-
- (Z)-9-Dodecen-12-olide (Yuzu lactone)
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -458.53 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.77 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.80 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 3.220 | Crippen Calculated Property | |
| McVol | 172.220 | ml/mol | McGowan Calculated Property |
| Pc | 2587.22 | kPa | Joback Calculated Property |
| Inp | 1531.00 | NIST | |
| I | [1986.00; 2018.00] |
|
|
| I | 1986.00 | NIST | |
| I | 2018.00 | NIST | |
| Tboil | 612.63 | K | Relay (1.0) Calculated Property |
| Tc | 805.45 | K | Relay (1.0) Calculated Property |
| Tfus | 289.07 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [433.98; 550.55] | J/mol×K | [577.11; 813.72] |
|
| Cp,gas | 433.98 | J/mol×K | 577.11 | Joback Calculated Property |
| Cp,gas | 457.24 | J/mol×K | 616.55 | Joback Calculated Property |
| Cp,gas | 478.98 | J/mol×K | 655.98 | Joback Calculated Property |
| Cp,gas | 499.19 | J/mol×K | 695.42 | Joback Calculated Property |
| Cp,gas | 517.87 | J/mol×K | 734.85 | Joback Calculated Property |
| Cp,gas | 534.99 | J/mol×K | 774.29 | Joback Calculated Property |
| Cp,gas | 550.55 | J/mol×K | 813.72 | Joback Calculated Property |
| η | [0.0000465; 0.0344479] | Pa×s | [262.11; 577.11] |
|
| η | 0.0344479 | Pa×s | 262.11 | Joback Calculated Property |
| η | 0.0045689 | Pa×s | 314.61 | Joback Calculated Property |
| η | 0.0010799 | Pa×s | 367.11 | Joback Calculated Property |
| η | 0.0003662 | Pa×s | 419.61 | Joback Calculated Property |
| η | 0.0001579 | Pa×s | 472.11 | Joback Calculated Property |
| η | 0.0000806 | Pa×s | 524.61 | Joback Calculated Property |
| η | 0.0000465 | Pa×s | 577.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 12-hydroxy-cis-9-dodecenoic acid lactone.
Sources
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