- InChI
- InChI=1S/C22H42O3/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-22(23)24-20-6-4-2/h4H,2-3,5-21H2,1H3
- InChI Key
- IZKMGIHXJFVCKF-UHFFFAOYSA-N
- Formula
- C22H42O3
- SMILES
- C=CCCOC(=O)OCCCCCCCCCCCCCCCCC
- Molecular Weight1
- 354.57
- 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).
- 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° | -116.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -749.00 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.46 | kJ/mol | Joback Calculated Property |
| log10WS | -7.81 | Crippen Calculated Property | |
| logPoct/wat | 7.587 | Crippen Calculated Property | |
| McVol | 329.850 | ml/mol | McGowan Calculated Property |
| Pc | 941.52 | kPa | Joback Calculated Property |
| Inp | [2412.00; 2412.00] |
|
|
| Inp | 2412.00 | NIST | |
| Inp | 2412.00 | NIST | |
| Tboil | 798.15 | K | Joback Calculated Property |
| Tc | 978.42 | K | Joback Calculated Property |
| Tfus | 430.33 | K | Joback Calculated Property |
| Vc | 1.290 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1037.68; 1141.73] | J/mol×K | [798.15; 978.42] |
|
| Cp,gas | 1037.68 | J/mol×K | 798.15 | Joback Calculated Property |
| Cp,gas | 1057.58 | J/mol×K | 828.19 | Joback Calculated Property |
| Cp,gas | 1076.42 | J/mol×K | 858.24 | Joback Calculated Property |
| Cp,gas | 1094.23 | J/mol×K | 888.28 | Joback Calculated Property |
| Cp,gas | 1111.04 | J/mol×K | 918.33 | Joback Calculated Property |
| Cp,gas | 1126.87 | J/mol×K | 948.37 | Joback Calculated Property |
| Cp,gas | 1141.73 | J/mol×K | 978.42 | Joback Calculated Property |
| η | [0.0000446; 0.0009012] | Pa×s | [430.33; 798.15] |
|
| η | 0.0009012 | Pa×s | 430.33 | Joback Calculated Property |
| η | 0.0003995 | Pa×s | 491.63 | Joback Calculated Property |
| η | 0.0002121 | Pa×s | 552.94 | Joback Calculated Property |
| η | 0.0001278 | Pa×s | 614.24 | Joback Calculated Property |
| η | 0.0000844 | Pa×s | 675.54 | Joback Calculated Property |
| η | 0.0000597 | Pa×s | 736.85 | Joback Calculated Property |
| η | 0.0000446 | Pa×s | 798.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, but-3-en-1-yl heptadecyl ester.
Sources
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