- InChI
- InChI=1S/C17H32O2/c1-2-3-4-5-6-7-8-9-10-11-13-16-14-12-15-17(18)19-16/h16H,2-15H2,1H3
- InChI Key
- SNHVOIJTSDIHOA-UHFFFAOYSA-N
- Formula
- C17H32O2
- SMILES
- CCCCCCCCCCCCC1CCCC(=O)O1
- Molecular Weight1
- 268.43
- 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).
- 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 |
|---|---|---|---|
| ω | 0.7892 | Relay (1.0) Calculated Property | |
| ΔfG° | -169.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -659.20 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 40.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 101.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.84 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 5.393 | Crippen Calculated Property | |
| McVol | 246.970 | ml/mol | McGowan Calculated Property |
| Pc | 1381.96 | kPa | Joback Calculated Property |
| Inp | [2089.00; 2089.00] |
|
|
| Inp | 2089.00 | NIST | |
| Inp | 2089.00 | NIST | |
| Tboil | 636.29 | K | Relay (1.0) Calculated Property |
| Tc | 816.73 | K | Relay (1.0) Calculated Property |
| Tfus | 294.06 | K | Relay (1.0) Calculated Property |
| Vc | 0.945 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [712.99; 816.38] | J/mol×K | [657.79; 834.93] |
|
| Cp,gas | 712.99 | J/mol×K | 657.79 | Joback Calculated Property |
| Cp,gas | 732.57 | J/mol×K | 687.31 | Joback Calculated Property |
| Cp,gas | 751.16 | J/mol×K | 716.84 | Joback Calculated Property |
| Cp,gas | 768.81 | J/mol×K | 746.36 | Joback Calculated Property |
| Cp,gas | 785.54 | J/mol×K | 775.88 | Joback Calculated Property |
| Cp,gas | 801.39 | J/mol×K | 805.41 | Joback Calculated Property |
| Cp,gas | 816.38 | J/mol×K | 834.93 | Joback Calculated Property |
| η | [0.0001863; 0.0032940] | Pa×s | [338.10; 657.79] |
|
| η | 0.0032940 | Pa×s | 338.10 | Joback Calculated Property |
| η | 0.0014732 | Pa×s | 391.38 | Joback Calculated Property |
| η | 0.0007990 | Pa×s | 444.66 | Joback Calculated Property |
| η | 0.0004940 | Pa×s | 497.94 | Joback Calculated Property |
| η | 0.0003351 | Pa×s | 551.23 | Joback Calculated Property |
| η | 0.0002435 | Pa×s | 604.51 | Joback Calculated Property |
| η | 0.0001863 | Pa×s | 657.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-Hydroxy-heptadecanoic acid, «delta»-lactone.
Sources
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