- InChI
- InChI=1S/C17H32O2/c1-3-5-7-9-10-11-12-13-15-17(18)19-16-14-8-6-4-2/h6,8H,3-5,7,9-16H2,1-2H3/b8-6-
- InChI Key
- HLDPXZRNQXKWRH-VURMDHGXSA-N
- Formula
- C17H32O2
- SMILES
- CCC=CCCOC(=O)CCCCCCCCCC
- Molecular Weight1
- 268.43
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -61.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -521.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.55 | kJ/mol | Joback Calculated Property |
| log10WS | -5.65 | Crippen Calculated Property | |
| logPoct/wat | 5.417 | Crippen Calculated Property | |
| McVol | 253.530 | ml/mol | McGowan Calculated Property |
| Pc | 1320.39 | kPa | Joback Calculated Property |
| Inp | [1860.00; 1860.00] |
|
|
| Inp | 1860.00 | NIST | |
| Inp | 1860.00 | NIST | |
| I | [2125.00; 2125.00] |
|
|
| I | 2125.00 | NIST | |
| I | 2125.00 | NIST | |
| Tboil | 668.81 | K | Joback Calculated Property |
| Tc | 841.03 | K | Joback Calculated Property |
| Tfus | 348.43 | K | Joback Calculated Property |
| Vc | 0.992 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [710.95; 806.79] | J/mol×K | [668.81; 841.03] |
|
| Cp,gas | 710.95 | J/mol×K | 668.81 | Joback Calculated Property |
| Cp,gas | 728.86 | J/mol×K | 697.51 | Joback Calculated Property |
| Cp,gas | 745.96 | J/mol×K | 726.22 | Joback Calculated Property |
| Cp,gas | 762.28 | J/mol×K | 754.92 | Joback Calculated Property |
| Cp,gas | 777.84 | J/mol×K | 783.62 | Joback Calculated Property |
| Cp,gas | 792.67 | J/mol×K | 812.33 | Joback Calculated Property |
| Cp,gas | 806.79 | J/mol×K | 841.03 | Joback Calculated Property |
| η | [0.0000930; 0.0020673] | Pa×s | [348.43; 668.81] |
|
| η | 0.0020673 | Pa×s | 348.43 | Joback Calculated Property |
| η | 0.0008745 | Pa×s | 401.83 | Joback Calculated Property |
| η | 0.0004527 | Pa×s | 455.22 | Joback Calculated Property |
| η | 0.0002691 | Pa×s | 508.62 | Joback Calculated Property |
| η | 0.0001766 | Pa×s | 562.02 | Joback Calculated Property |
| η | 0.0001246 | Pa×s | 615.41 | Joback Calculated Property |
| η | 0.0000930 | Pa×s | 668.81 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (Z)-3-hexenyl undecanoate.
Sources
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