- InChI
- InChI=1S/C16H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16(2)17/h3-4,6-7H,5,8-15H2,1-2H3/b4-3+,7-6-
- InChI Key
- ZZGJZGSVLNSDPG-FDTUMDBZSA-N
- Formula
- C16H28O2
- SMILES
- CC=CCC=CCCCCCCCCOC(C)=O
- Molecular Weight1
- 252.39
- CAS
- 31654-77-0
- Other Names
-
- (Z)-9-(E)-12-Tetradecadien-1-ol acetate
- Z,E-9,12-Tetradecadien-1-yl acetate
- Z,E-9,12-Tetradecadien-1-ol acetate
- (9Z,12E)-9,12-Tetradecadienyl acetate
- (Z,E)-9,12-tetradecenyl acetate
- (Z)-9-(E)-12-Tetradecadienyl acetate
- (Z,E)-tetradeca-9,12-dienyl acetate
- 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° | 10.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -383.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.28 | kJ/mol | Joback Calculated Property |
| log10WS | -5.09 | Crippen Calculated Property | |
| logPoct/wat | 4.803 | Crippen Calculated Property | |
| McVol | 235.140 | ml/mol | McGowan Calculated Property |
| Pc | 1474.75 | kPa | Joback Calculated Property |
| Inp | [1811.00; 1811.00] |
|
|
| Inp | 1811.00 | NIST | |
| Inp | 1811.00 | NIST | |
| I | 2222.00 | NIST | |
| Tboil | 650.09 | K | Joback Calculated Property |
| Tc | 827.94 | K | Joback Calculated Property |
| Tfus | 332.08 | K | Joback Calculated Property |
| Vc | 0.915 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [634.12; 725.06] | J/mol×K | [650.09; 827.94] |
|
| Cp,gas | 634.12 | J/mol×K | 650.09 | Joback Calculated Property |
| Cp,gas | 651.17 | J/mol×K | 679.73 | Joback Calculated Property |
| Cp,gas | 667.42 | J/mol×K | 709.37 | Joback Calculated Property |
| Cp,gas | 682.90 | J/mol×K | 739.01 | Joback Calculated Property |
| Cp,gas | 697.64 | J/mol×K | 768.65 | Joback Calculated Property |
| Cp,gas | 711.69 | J/mol×K | 798.30 | Joback Calculated Property |
| Cp,gas | 725.06 | J/mol×K | 827.94 | Joback Calculated Property |
| η | [0.0000900; 0.0020986] | Pa×s | [332.08; 650.09] |
|
| η | 0.0020986 | Pa×s | 332.08 | Joback Calculated Property |
| η | 0.0008652 | Pa×s | 385.08 | Joback Calculated Property |
| η | 0.0004420 | Pa×s | 438.08 | Joback Calculated Property |
| η | 0.0002610 | Pa×s | 491.09 | Joback Calculated Property |
| η | 0.0001708 | Pa×s | 544.09 | Joback Calculated Property |
| η | 0.0001205 | Pa×s | 597.09 | Joback Calculated Property |
| η | 0.0000900 | Pa×s | 650.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 9,12-Tetradecadien-1-ol, acetate, (Z,E)-.
Sources
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