- InChI
- InChI=1S/C22H40O5/c1-3-4-5-6-7-8-9-10-13-16-26-21(23)19-14-11-12-15-20(19)22(24)27-18-17-25-2/h19-20H,3-18H2,1-2H3
- InChI Key
- UHDRAJAHQQSABX-UHFFFAOYSA-N
- Formula
- C22H40O5
- SMILES
-
CCCCCCCCCCCOC(=O)C1CCCCC1C(=O)
OCCOC - Molecular Weight1
- 384.55
- 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° | -421.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1085.25 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 52.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.41 | kJ/mol | Joback Calculated Property |
| log10WS | -5.26 | Crippen Calculated Property | |
| logPoct/wat | 5.056 | Crippen Calculated Property | |
| McVol | 330.730 | ml/mol | McGowan Calculated Property |
| Pc | 1052.09 | kPa | Joback Calculated Property |
| Inp | [2645.00; 2645.00] |
|
|
| Inp | 2645.00 | NIST | |
| Inp | 2645.00 | NIST | |
| Tboil | 892.64 | K | Joback Calculated Property |
| Tc | 1094.65 | K | Joback Calculated Property |
| Tfus | 507.39 | K | Joback Calculated Property |
| Vc | 1.266 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1124.90; 1214.82] | J/mol×K | [892.64; 1094.65] |
|
| Cp,gas | 1124.90 | J/mol×K | 892.64 | Joback Calculated Property |
| Cp,gas | 1143.76 | J/mol×K | 926.31 | Joback Calculated Property |
| Cp,gas | 1161.06 | J/mol×K | 959.98 | Joback Calculated Property |
| Cp,gas | 1176.80 | J/mol×K | 993.64 | Joback Calculated Property |
| Cp,gas | 1191.00 | J/mol×K | 1027.31 | Joback Calculated Property |
| Cp,gas | 1203.67 | J/mol×K | 1060.98 | Joback Calculated Property |
| Cp,gas | 1214.82 | J/mol×K | 1094.65 | Joback Calculated Property |
| η | [0.0000398; 0.0005641] | Pa×s | [507.39; 892.64] |
|
| η | 0.0005641 | Pa×s | 507.39 | Joback Calculated Property |
| η | 0.0002829 | Pa×s | 571.60 | Joback Calculated Property |
| η | 0.0001631 | Pa×s | 635.81 | Joback Calculated Property |
| η | 0.0001040 | Pa×s | 700.01 | Joback Calculated Property |
| η | 0.0000716 | Pa×s | 764.22 | Joback Calculated Property |
| η | 0.0000522 | Pa×s | 828.43 | Joback Calculated Property |
| η | 0.0000398 | Pa×s | 892.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-methoxyethyl undecyl ester.
Sources
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