- InChI
- InChI=1S/C22H38O4/c1-3-5-6-7-8-9-10-11-14-18-26-22(24)20-16-13-12-15-19(20)21(23)25-17-4-2/h4,19-20H,2-3,5-18H2,1H3
- InChI Key
- VNCZFWBAAZCFMH-UHFFFAOYSA-N
- Formula
- C22H38O4
- SMILES
-
C=CCOC(=O)C1CCCCC1C(=O)OCCCCCC
CCCCC - Molecular Weight1
- 366.53
- 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° | -228.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -827.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.94 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.33 | kJ/mol | Joback Calculated Property |
| log10WS | -6.02 | Crippen Calculated Property | |
| logPoct/wat | 5.596 | Crippen Calculated Property | |
| McVol | 320.560 | ml/mol | McGowan Calculated Property |
| Pc | 1093.54 | kPa | Joback Calculated Property |
| Inp | [2538.00; 2538.00] |
|
|
| Inp | 2538.00 | NIST | |
| Inp | 2538.00 | NIST | |
| Tboil | 866.90 | K | Joback Calculated Property |
| Tc | 1066.40 | K | Joback Calculated Property |
| Tfus | 483.40 | K | Joback Calculated Property |
| Vc | 1.228 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1064.76; 1158.41] | J/mol×K | [866.90; 1066.40] |
|
| Cp,gas | 1064.76 | J/mol×K | 866.90 | Joback Calculated Property |
| Cp,gas | 1083.78 | J/mol×K | 900.15 | Joback Calculated Property |
| Cp,gas | 1101.40 | J/mol×K | 933.40 | Joback Calculated Property |
| Cp,gas | 1117.65 | J/mol×K | 966.65 | Joback Calculated Property |
| Cp,gas | 1132.55 | J/mol×K | 999.90 | Joback Calculated Property |
| Cp,gas | 1146.13 | J/mol×K | 1033.15 | Joback Calculated Property |
| Cp,gas | 1158.41 | J/mol×K | 1066.40 | Joback Calculated Property |
| η | [0.0000572; 0.0008353] | Pa×s | [483.40; 866.90] |
|
| η | 0.0008353 | Pa×s | 483.40 | Joback Calculated Property |
| η | 0.0004115 | Pa×s | 547.32 | Joback Calculated Property |
| η | 0.0002351 | Pa×s | 611.23 | Joback Calculated Property |
| η | 0.0001494 | Pa×s | 675.15 | Joback Calculated Property |
| η | 0.0001026 | Pa×s | 739.07 | Joback Calculated Property |
| η | 0.0000748 | Pa×s | 802.98 | Joback Calculated Property |
| η | 0.0000572 | Pa×s | 866.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, allyl undecyl ester.
Sources
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