- InChI
- InChI=1S/C11H22O3/c1-3-4-5-6-7-8-9-14-11(13)10(2)12/h10,12H,3-9H2,1-2H3
- InChI Key
- SFBIZPBTKROSDE-UHFFFAOYSA-N
- Formula
- C11H22O3
- SMILES
- CCCCCCCCOC(=O)C(C)O
- Molecular Weight1
- 202.29
- 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).
- 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 | 0.8133 | Relay (... Calculated Property | |
| ΔfG° | -331.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -766.35 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 27.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.15 | kJ/mol | Relay (... Calculated Property |
| IE | 9.94 | eV | Relay (... Calculated Property |
| log10WS | -1.27 | Aq. Sol... | |
| logPoct/wat | 2.271 | Crippen Calculated Property | |
| McVol | 179.160 | ml/mol | McGowan Calculated Property |
| Pc | 2208.29 | kPa | Joback Calculated Property |
| Tboil | 512.37 | K | Relay (... Calculated Property |
| Tc | 702.42 | K | Relay (... Calculated Property |
| Tfus | 273.88 | K | Relay (... Calculated Property |
| Vc | 0.694 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [479.00; 550.21] | J/mol×K | [619.11; 788.09] | 
|
| Cp,gas | 479.00 | J/mol×K | 619.11 | Joback Calculated Property |
| Cp,gas | 492.23 | J/mol×K | 647.27 | Joback Calculated Property |
| Cp,gas | 504.91 | J/mol×K | 675.44 | Joback Calculated Property |
| Cp,gas | 517.04 | J/mol×K | 703.60 | Joback Calculated Property |
| Cp,gas | 528.63 | J/mol×K | 731.76 | Joback Calculated Property |
| Cp,gas | 539.68 | J/mol×K | 759.93 | Joback Calculated Property |
| Cp,gas | 550.21 | J/mol×K | 788.09 | Joback Calculated Property |
| η | [0.0000600; 0.0077301] | Pa×s | [331.71; 619.11] |
|
| η | 0.0077301 | Pa×s | 331.71 | Joback Calculated Property |
| η | 0.0020635 | Pa×s | 379.61 | Joback Calculated Property |
| η | 0.0007406 | Pa×s | 427.51 | Joback Calculated Property |
| η | 0.0003267 | Pa×s | 475.41 | Joback Calculated Property |
| η | 0.0001675 | Pa×s | 523.31 | Joback Calculated Property |
| η | 0.0000960 | Pa×s | 571.21 | Joback Calculated Property |
| η | 0.0000600 | Pa×s | 619.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to octyl 2-hydroxypropanoate.
Sources
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