- InChI
- InChI=1S/C16H28O5/c1-2-3-4-5-11-20-15(17)9-6-10-16(18)21-13-14-8-7-12-19-14/h14H,2-13H2,1H3
- InChI Key
- BJAANRCRIWFPRT-UHFFFAOYSA-N
- Formula
- C16H28O5
- SMILES
- CCCCCCOC(=O)CCCC(=O)OCC1CCCO1
- Molecular Weight1
- 300.39
- 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).
- 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 | 0.8601 | Relay (1.0) Calculated Property | |
| ΔfG° | -433.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1052.20 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 44.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.16 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.45 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.53 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.002 | Crippen Calculated Property | |
| McVol | 246.190 | ml/mol | McGowan Calculated Property |
| Pc | 1611.58 | kPa | Joback Calculated Property |
| Inp | 2208.00 | NIST | |
| Tboil | 622.34 | K | Relay (1.0) Calculated Property |
| Tc | 789.02 | K | Relay (1.0) Calculated Property |
| Tfus | 258.40 | K | Relay (1.0) Calculated Property |
| Vc | 0.945 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [759.76; 846.65] | J/mol×K | [760.29; 952.60] | 
|
| Cp,gas | 759.76 | J/mol×K | 760.29 | Joback Calculated Property |
| Cp,gas | 776.78 | J/mol×K | 792.34 | Joback Calculated Property |
| Cp,gas | 792.77 | J/mol×K | 824.39 | Joback Calculated Property |
| Cp,gas | 807.73 | J/mol×K | 856.45 | Joback Calculated Property |
| Cp,gas | 821.68 | J/mol×K | 888.50 | Joback Calculated Property |
| Cp,gas | 834.65 | J/mol×K | 920.55 | Joback Calculated Property |
| Cp,gas | 846.65 | J/mol×K | 952.60 | Joback Calculated Property |
| η | [0.0001192; 0.0013349] | Pa×s | [451.87; 760.29] |
|
| η | 0.0013349 | Pa×s | 451.87 | Joback Calculated Property |
| η | 0.0007265 | Pa×s | 503.27 | Joback Calculated Property |
| η | 0.0004426 | Pa×s | 554.68 | Joback Calculated Property |
| η | 0.0002933 | Pa×s | 606.08 | Joback Calculated Property |
| η | 0.0002073 | Pa×s | 657.48 | Joback Calculated Property |
| η | 0.0001540 | Pa×s | 708.89 | Joback Calculated Property |
| η | 0.0001192 | Pa×s | 760.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, hexyl tetrahydrofurfuryl ester.
Sources
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