- InChI
- InChI=1S/C25H47ClO4/c1-2-3-4-12-17-22-29-24(27)19-14-9-5-6-10-15-20-25(28)30-23-18-13-8-7-11-16-21-26/h2-23H2,1H3
- InChI Key
- MOTJDFRDZICTLN-UHFFFAOYSA-N
- Formula
- C25H47ClO4
- SMILES
-
CCCCCCCOC(=O)CCCCCCCCC(=O)OCCC
CCCCCCl - Molecular Weight1
- 447.09
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.2624 | Relay (1.0) Calculated Property | |
| ΔfG° | -320.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1200.02 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 70.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 125.11 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.88 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.03 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.743 | Crippen Calculated Property | |
| McVol | 390.230 | ml/mol | McGowan Calculated Property |
| Pc | 787.71 | kPa | Joback Calculated Property |
| Inp | [3207.00; 3207.00] |
|
|
| Inp | 3207.00 | NIST | |
| Inp | 3207.00 | NIST | |
| Tboil | 657.77 | K | Relay (1.0) Calculated Property |
| Tc | 844.33 | K | Relay (1.0) Calculated Property |
| Tfus | 310.22 | K | Relay (1.0) Calculated Property |
| Vc | 1.500 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1311.77; 1407.37] | J/mol×K | [961.41; 1183.64] |
|
| Cp,gas | 1311.77 | J/mol×K | 961.41 | Joback Calculated Property |
| Cp,gas | 1331.62 | J/mol×K | 998.45 | Joback Calculated Property |
| Cp,gas | 1349.83 | J/mol×K | 1035.49 | Joback Calculated Property |
| Cp,gas | 1366.46 | J/mol×K | 1072.52 | Joback Calculated Property |
| Cp,gas | 1381.56 | J/mol×K | 1109.56 | Joback Calculated Property |
| Cp,gas | 1395.18 | J/mol×K | 1146.60 | Joback Calculated Property |
| Cp,gas | 1407.37 | J/mol×K | 1183.64 | Joback Calculated Property |
| η | [0.0000211; 0.0003575] | Pa×s | [545.75; 961.41] |
|
| η | 0.0003575 | Pa×s | 545.75 | Joback Calculated Property |
| η | 0.0001710 | Pa×s | 615.03 | Joback Calculated Property |
| η | 0.0000950 | Pa×s | 684.30 | Joback Calculated Property |
| η | 0.0000588 | Pa×s | 753.58 | Joback Calculated Property |
| η | 0.0000394 | Pa×s | 822.86 | Joback Calculated Property |
| η | 0.0000281 | Pa×s | 892.13 | Joback Calculated Property |
| η | 0.0000211 | Pa×s | 961.41 | Joback Calculated Property |
Similar Compounds
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Sources
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