- InChI
- InChI=1S/C20H38O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-20(21)23-19(2)3/h2,4-18H2,1,3H3
- InChI Key
- NPIONMYPQNAYPB-UHFFFAOYSA-N
- Formula
- C20H38O3
- SMILES
- C=C(C)OC(=O)OCCCCCCCCCCCCCCCC
- Molecular Weight1
- 326.51
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -142.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -717.51 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.94 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.09 | kJ/mol | Joback Calculated Property |
| log10WS | -7.47 | Crippen Calculated Property | |
| logPoct/wat | 7.154 | Crippen Calculated Property | |
| McVol | 301.670 | ml/mol | McGowan Calculated Property |
| Pc | 1066.57 | kPa | Joback Calculated Property |
| Inp | [2189.00; 2189.00] |
|
|
| Inp | 2189.00 | NIST | |
| Inp | 2189.00 | NIST | |
| Tboil | 752.27 | K | Joback Calculated Property |
| Tc | 927.58 | K | Joback Calculated Property |
| Tfus | 393.83 | K | Joback Calculated Property |
| Vc | 1.179 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [915.25; 1015.91] | J/mol×K | [752.27; 927.58] |
|
| Cp,gas | 915.25 | J/mol×K | 752.27 | Joback Calculated Property |
| Cp,gas | 934.31 | J/mol×K | 781.49 | Joback Calculated Property |
| Cp,gas | 952.43 | J/mol×K | 810.71 | Joback Calculated Property |
| Cp,gas | 969.63 | J/mol×K | 839.93 | Joback Calculated Property |
| Cp,gas | 985.93 | J/mol×K | 869.15 | Joback Calculated Property |
| Cp,gas | 1001.35 | J/mol×K | 898.36 | Joback Calculated Property |
| Cp,gas | 1015.91 | J/mol×K | 927.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, hexadecyl prop-1-en-2-yl ester.
Sources
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