- InChI
- InChI=1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14(2)15/h7-8H,3-6,9-13H2,1-2H3/b8-7+
- InChI Key
- LMNJOGUUFQYRPE-BQYQJAHWSA-N
- Formula
- C14H26O2
- SMILES
- CCCCC/C=C/CCCCCOC(C)=O
- Molecular Weight1
- 226.36
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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).
- 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 | 0.6668 | Relay (1.0) Calculated Property | |
| ΔfG° | -163.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -563.33 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 36.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.71 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.79 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.54 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.246 | Crippen Calculated Property | |
| McVol | 211.260 | ml/mol | McGowan Calculated Property |
| Pc | 1593.62 | kPa | Joback Calculated Property |
| Inp | [1598.00; 1598.00] |
|
|
| Inp | 1598.00 | NIST | |
| Inp | 1598.00 | NIST | |
| I | [1963.00; 1972.00] |
|
|
| I | 1972.00 | NIST | |
| I | 1963.00 | NIST | |
| I | 1972.00 | NIST | |
| Tboil | 537.31 | K | Relay (1.0) Calculated Property |
| Tc | 714.64 | K | Relay (1.0) Calculated Property |
| Tfus | 243.77 | K | Relay (1.0) Calculated Property |
| Vc | 0.792 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [540.08; 629.88] | J/mol×K | [582.30; 753.71] |
|
| Cp,gas | 540.08 | J/mol×K | 582.30 | Joback Calculated Property |
| Cp,gas | 556.86 | J/mol×K | 610.87 | Joback Calculated Property |
| Cp,gas | 572.88 | J/mol×K | 639.44 | Joback Calculated Property |
| Cp,gas | 588.17 | J/mol×K | 668.00 | Joback Calculated Property |
| Cp,gas | 602.76 | J/mol×K | 696.57 | Joback Calculated Property |
| Cp,gas | 616.65 | J/mol×K | 725.14 | Joback Calculated Property |
| Cp,gas | 629.88 | J/mol×K | 753.71 | Joback Calculated Property |
| η | [0.0001194; 0.0042750] | Pa×s | [284.79; 582.30] |
|
| η | 0.0042750 | Pa×s | 284.79 | Joback Calculated Property |
| η | 0.0015131 | Pa×s | 334.37 | Joback Calculated Property |
| η | 0.0007003 | Pa×s | 383.96 | Joback Calculated Property |
| η | 0.0003866 | Pa×s | 433.54 | Joback Calculated Property |
| η | 0.0002411 | Pa×s | 483.13 | Joback Calculated Property |
| η | 0.0001642 | Pa×s | 532.71 | Joback Calculated Property |
| η | 0.0001194 | Pa×s | 582.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to E-6-dodecenyl acetate.
Sources
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