- InChI
- InChI=1S/C14H28O3/c1-3-5-6-7-8-9-10-11-13(15)12-14(16)17-4-2/h13,15H,3-12H2,1-2H3
- InChI Key
- CQLRIUYMQWJYSR-UHFFFAOYSA-N
- Formula
- C14H28O3
- SMILES
- CCCCCCCCCC(O)CC(=O)OCC
- Molecular Weight1
- 244.37
- CAS
- 126679-28-5
- Other Names
-
- Ethyl 3-hydroxy dodecanoate
- 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 | 0.8919 | Relay (1.0) Calculated Property | |
| ΔfG° | -306.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -837.77 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 35.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.57 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.82 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.50 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.441 | Crippen Calculated Property | |
| McVol | 221.430 | ml/mol | McGowan Calculated Property |
| Pc | 1713.19 | kPa | Joback Calculated Property |
| Inp | [1743.00; 1743.00] |
|
|
| Inp | 1743.00 | NIST | |
| Inp | 1743.00 | NIST | |
| Inp | 1743.00 | NIST | |
| Tboil | 558.48 | K | Relay (1.0) Calculated Property |
| Tc | 744.28 | K | Relay (1.0) Calculated Property |
| Tfus | 298.57 | K | Relay (1.0) Calculated Property |
| Vc | 0.850 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [637.98; 718.00] | J/mol×K | [687.75; 857.11] |
|
| Cp,gas | 637.98 | J/mol×K | 687.75 | Joback Calculated Property |
| Cp,gas | 652.97 | J/mol×K | 715.98 | Joback Calculated Property |
| Cp,gas | 667.27 | J/mol×K | 744.20 | Joback Calculated Property |
| Cp,gas | 680.92 | J/mol×K | 772.43 | Joback Calculated Property |
| Cp,gas | 693.91 | J/mol×K | 800.66 | Joback Calculated Property |
| Cp,gas | 706.27 | J/mol×K | 828.88 | Joback Calculated Property |
| Cp,gas | 718.00 | J/mol×K | 857.11 | Joback Calculated Property |
| η | [0.0000344; 0.0042282] | Pa×s | [365.52; 687.75] |
|
| η | 0.0042282 | Pa×s | 365.52 | Joback Calculated Property |
| η | 0.0011342 | Pa×s | 419.22 | Joback Calculated Property |
| η | 0.0004102 | Pa×s | 472.93 | Joback Calculated Property |
| η | 0.0001826 | Pa×s | 526.63 | Joback Calculated Property |
| η | 0.0000944 | Pa×s | 580.34 | Joback Calculated Property |
| η | 0.0000546 | Pa×s | 634.05 | Joback Calculated Property |
| η | 0.0000344 | Pa×s | 687.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dodecanoic acid, 3-hydroxy-, ethyl ester.
Sources
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