- InChI
- InChI=1S/C22H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-22(23)24-20-21-17-15-16-18-21/h7-8,21H,2-6,9-20H2,1H3/b8-7-
- InChI Key
- XIMXXGSYXRPYEN-FPLPWBNLSA-N
- Formula
- C22H40O2
- SMILES
- CCCCCCC=CCCCCCCCC(=O)OCC1CCCC1
- Molecular Weight1
- 336.55
- 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° | 17.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -564.51 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.94 | kJ/mol | Joback Calculated Property |
| log10WS | -7.40 | Crippen Calculated Property | |
| logPoct/wat | 6.977 | Crippen Calculated Property | |
| McVol | 313.120 | ml/mol | McGowan Calculated Property |
| Pc | 1073.57 | kPa | Joback Calculated Property |
| Inp | [2480.00; 2480.00] |
|
|
| Inp | 2480.00 | NIST | |
| Inp | 2480.00 | NIST | |
| Inp | 2480.00 | NIST | |
| Tboil | 798.49 | K | Joback Calculated Property |
| Tc | 987.35 | K | Joback Calculated Property |
| Tfus | 415.68 | K | Joback Calculated Property |
| Vc | 1.212 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1000.76; 1108.59] | J/mol×K | [798.49; 987.35] |
|
| Cp,gas | 1000.76 | J/mol×K | 798.49 | Joback Calculated Property |
| Cp,gas | 1021.40 | J/mol×K | 829.97 | Joback Calculated Property |
| Cp,gas | 1040.90 | J/mol×K | 861.44 | Joback Calculated Property |
| Cp,gas | 1059.32 | J/mol×K | 892.92 | Joback Calculated Property |
| Cp,gas | 1076.71 | J/mol×K | 924.39 | Joback Calculated Property |
| Cp,gas | 1093.12 | J/mol×K | 955.87 | Joback Calculated Property |
| Cp,gas | 1108.59 | J/mol×K | 987.35 | Joback Calculated Property |
| η | [0.0000714; 0.0014952] | Pa×s | [415.68; 798.49] |
|
| η | 0.0014952 | Pa×s | 415.68 | Joback Calculated Property |
| η | 0.0006428 | Pa×s | 479.48 | Joback Calculated Property |
| η | 0.0003369 | Pa×s | 543.28 | Joback Calculated Property |
| η | 0.0002023 | Pa×s | 607.09 | Joback Calculated Property |
| η | 0.0001338 | Pa×s | 670.89 | Joback Calculated Property |
| η | 0.0000951 | Pa×s | 734.69 | Joback Calculated Property |
| η | 0.0000714 | Pa×s | 798.49 | Joback Calculated Property |
Similar Compounds
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Sources
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