- InChI
- InChI=1S/C15H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-15(2)16/h12-13H,3-11,14H2,1-2H3/b13-12+
- InChI Key
- UEGGJCHDRZTQMF-OUKQBFOZSA-N
- Formula
- C15H28O2
- SMILES
- CCCCCCCCCC/C=C/COC(C)=O
- Molecular Weight1
- 240.39
- 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).
- 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 | 0.6997 | Relay (1.0) Calculated Property | |
| ΔfG° | -154.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -571.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.70 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.06 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.36 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.636 | Crippen Calculated Property | |
| McVol | 225.350 | ml/mol | McGowan Calculated Property |
| Pc | 1478.15 | kPa | Joback Calculated Property |
| I | [1870.00; 1870.00] |
|
|
| I | 1870.00 | NIST | |
| I | 1870.00 | NIST | |
| Tboil | 546.84 | K | Relay (1.0) Calculated Property |
| Tc | 727.78 | K | Relay (1.0) Calculated Property |
| Tfus | 249.73 | K | Relay (1.0) Calculated Property |
| Vc | 0.847 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [592.87; 685.22] | J/mol×K | [605.18; 775.70] |
|
| Cp,gas | 592.87 | J/mol×K | 605.18 | Joback Calculated Property |
| Cp,gas | 610.14 | J/mol×K | 633.60 | Joback Calculated Property |
| Cp,gas | 626.62 | J/mol×K | 662.02 | Joback Calculated Property |
| Cp,gas | 642.35 | J/mol×K | 690.44 | Joback Calculated Property |
| Cp,gas | 657.35 | J/mol×K | 718.86 | Joback Calculated Property |
| Cp,gas | 671.63 | J/mol×K | 747.28 | Joback Calculated Property |
| Cp,gas | 685.22 | J/mol×K | 775.70 | Joback Calculated Property |
| η | [0.0001066; 0.0039170] | Pa×s | [296.06; 605.18] |
|
| η | 0.0039170 | Pa×s | 296.06 | Joback Calculated Property |
| η | 0.0013765 | Pa×s | 347.58 | Joback Calculated Property |
| η | 0.0006337 | Pa×s | 399.10 | Joback Calculated Property |
| η | 0.0003483 | Pa×s | 450.62 | Joback Calculated Property |
| η | 0.0002165 | Pa×s | 502.14 | Joback Calculated Property |
| η | 0.0001470 | Pa×s | 553.66 | Joback Calculated Property |
| η | 0.0001066 | Pa×s | 605.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Tridecen-2-yl acetate.
Sources
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