- InChI
- InChI=1S/C10H20O3/c1-3-4-5-6-7-13-10(12)8-9(2)11/h9,11H,3-8H2,1-2H3
- InChI Key
- NUOMIZNYSYMUJI-UHFFFAOYSA-N
- Formula
- C10H20O3
- SMILES
- CCCCCCOC(=O)CC(C)O
- Molecular Weight1
- 188.26
- 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).
- 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° | -339.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -652.04 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.30 | kJ/mol | Joback Calculated Property |
| log10WS | -2.25 | Crippen Calculated Property | |
| logPoct/wat | 1.881 | Crippen Calculated Property | |
| McVol | 165.070 | ml/mol | McGowan Calculated Property |
| Pc | 2421.88 | kPa | Joback Calculated Property |
| I | 1906.00 | NIST | |
| Tboil | 596.23 | K | Joback Calculated Property |
| Tc | 765.82 | K | Joback Calculated Property |
| Tfus | 320.44 | K | Joback Calculated Property |
| Vc | 0.632 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [428.91; 496.65] | J/mol×K | [596.23; 765.82] | 
|
| Cp,gas | 428.91 | J/mol×K | 596.23 | Joback Calculated Property |
| Cp,gas | 441.47 | J/mol×K | 624.50 | Joback Calculated Property |
| Cp,gas | 453.52 | J/mol×K | 652.76 | Joback Calculated Property |
| Cp,gas | 465.05 | J/mol×K | 681.03 | Joback Calculated Property |
| Cp,gas | 476.07 | J/mol×K | 709.29 | Joback Calculated Property |
| Cp,gas | 486.60 | J/mol×K | 737.56 | Joback Calculated Property |
| Cp,gas | 496.65 | J/mol×K | 765.82 | Joback Calculated Property |
| η | [0.0000721; 0.0094549] | Pa×s | [320.44; 596.23] |
|
| η | 0.0094549 | Pa×s | 320.44 | Joback Calculated Property |
| η | 0.0025198 | Pa×s | 366.41 | Joback Calculated Property |
| η | 0.0009018 | Pa×s | 412.37 | Joback Calculated Property |
| η | 0.0003966 | Pa×s | 458.34 | Joback Calculated Property |
| η | 0.0002026 | Pa×s | 504.30 | Joback Calculated Property |
| η | 0.0001158 | Pa×s | 550.27 | Joback Calculated Property |
| η | 0.0000721 | Pa×s | 596.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to hexyl 3-hydroxybutanoate.
Sources
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