- InChI
- InChI=1S/C17H34O2/c1-5-6-7-8-9-10-11-12-13-14-17(18)19-16(4)15(2)3/h15-16H,5-14H2,1-4H3
- InChI Key
- BPATUEDDMFPLJI-UHFFFAOYSA-N
- Formula
- C17H34O2
- SMILES
- CCCCCCCCCCCC(=O)OC(C)C(C)C
- Molecular Weight1
- 270.45
- 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.
- 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° | -146.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -649.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.82 | kJ/mol | Joback Calculated Property |
| log10WS | -5.67 | Crippen Calculated Property | |
| logPoct/wat | 5.495 | Crippen Calculated Property | |
| McVol | 257.830 | ml/mol | McGowan Calculated Property |
| Pc | 1286.51 | kPa | Joback Calculated Property |
| Inp | 1816.00 | NIST | |
| Tboil | 663.77 | K | Joback Calculated Property |
| Tc | 835.50 | K | Joback Calculated Property |
| Tfus | 323.51 | K | Joback Calculated Property |
| Vc | 1.000 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [733.07; 833.92] | J/mol×K | [663.77; 835.50] | 
|
| Cp,gas | 733.07 | J/mol×K | 663.77 | Joback Calculated Property |
| Cp,gas | 751.93 | J/mol×K | 692.39 | Joback Calculated Property |
| Cp,gas | 769.95 | J/mol×K | 721.01 | Joback Calculated Property |
| Cp,gas | 787.14 | J/mol×K | 749.64 | Joback Calculated Property |
| Cp,gas | 803.52 | J/mol×K | 778.26 | Joback Calculated Property |
| Cp,gas | 819.11 | J/mol×K | 806.88 | Joback Calculated Property |
| Cp,gas | 833.92 | J/mol×K | 835.50 | Joback Calculated Property |
| η | [0.0000931; 0.0038870] | Pa×s | [323.51; 663.77] |
|
| η | 0.0038870 | Pa×s | 323.51 | Joback Calculated Property |
| η | 0.0013124 | Pa×s | 380.22 | Joback Calculated Property |
| η | 0.0005874 | Pa×s | 436.93 | Joback Calculated Property |
| η | 0.0003162 | Pa×s | 493.64 | Joback Calculated Property |
| η | 0.0001934 | Pa×s | 550.35 | Joback Calculated Property |
| η | 0.0001297 | Pa×s | 607.06 | Joback Calculated Property |
| η | 0.0000931 | Pa×s | 663.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dodecanoic acid, 3-methylbutyl-2 ester.
Sources
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