- InChI
- InChI=1S/C23H35ClO4/c1-3-4-11-16-27-22(25)12-9-7-5-6-8-10-13-23(26)28-18-20-14-15-21(24)17-19(20)2/h14-15,17H,3-13,16,18H2,1-2H3
- InChI Key
- TUBFDROSCKWEKJ-UHFFFAOYSA-N
- Formula
- C23H35ClO4
- SMILES
-
CCCCCOC(=O)CCCCCCCCC(=O)OCc1cc
c(Cl)cc1C - Molecular Weight1
- 410.98
- 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° | -243.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -809.80 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 58.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.09 | kJ/mol | Joback Calculated Property |
| log10WS | -7.52 | Crippen Calculated Property | |
| logPoct/wat | 6.546 | Crippen Calculated Property | |
| McVol | 338.290 | ml/mol | McGowan Calculated Property |
| Pc | 1061.02 | kPa | Joback Calculated Property |
| Inp | [2959.00; 2959.00] |
|
|
| Inp | 2959.00 | NIST | |
| Inp | 2959.00 | NIST | |
| Tboil | 952.29 | K | Joback Calculated Property |
| Tc | 1166.50 | K | Joback Calculated Property |
| Tfus | 574.67 | K | Joback Calculated Property |
| Vc | 1.312 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1084.19; 1157.64] | J/mol×K | [952.29; 1166.50] |
|
| Cp,gas | 1084.19 | J/mol×K | 952.29 | Joback Calculated Property |
| Cp,gas | 1099.71 | J/mol×K | 987.99 | Joback Calculated Property |
| Cp,gas | 1113.87 | J/mol×K | 1023.69 | Joback Calculated Property |
| Cp,gas | 1126.72 | J/mol×K | 1059.39 | Joback Calculated Property |
| Cp,gas | 1138.27 | J/mol×K | 1095.10 | Joback Calculated Property |
| Cp,gas | 1148.57 | J/mol×K | 1130.80 | Joback Calculated Property |
| Cp,gas | 1157.64 | J/mol×K | 1166.50 | Joback Calculated Property |
| η | [0.0000309; 0.0003047] | Pa×s | [574.67; 952.29] |
|
| η | 0.0003047 | Pa×s | 574.67 | Joback Calculated Property |
| η | 0.0001724 | Pa×s | 637.61 | Joback Calculated Property |
| η | 0.0001081 | Pa×s | 700.54 | Joback Calculated Property |
| η | 0.0000732 | Pa×s | 763.48 | Joback Calculated Property |
| η | 0.0000526 | Pa×s | 826.42 | Joback Calculated Property |
| η | 0.0000396 | Pa×s | 889.35 | Joback Calculated Property |
| η | 0.0000309 | Pa×s | 952.29 | Joback Calculated Property |
Similar Compounds
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Sources
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