- InChI
- InChI=1S/C24H45ClO4/c1-2-3-21-28-23(26)18-14-10-6-7-11-15-19-24(27)29-22-17-13-9-5-4-8-12-16-20-25/h2-22H2,1H3
- InChI Key
- BTTCEUOPIBQMJW-UHFFFAOYSA-N
- Formula
- C24H45ClO4
- SMILES
-
CCCCOC(=O)CCCCCCCCC(=O)OCCCCCC
CCCCCl - Molecular Weight1
- 433.06
- 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 | 1.2274 | Relay (1.0) Calculated Property | |
| ΔfG° | -328.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1181.21 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 67.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 122.93 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.88 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.73 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.353 | Crippen Calculated Property | |
| McVol | 376.140 | ml/mol | McGowan Calculated Property |
| Pc | 831.94 | kPa | Joback Calculated Property |
| Inp | 3109.00 | NIST | |
| Tboil | 650.65 | K | Relay (1.0) Calculated Property |
| Tc | 836.68 | K | Relay (1.0) Calculated Property |
| Tfus | 305.02 | K | Relay (1.0) Calculated Property |
| Vc | 1.446 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1248.50; 1342.63] | J/mol×K | [938.53; 1152.36] | 
|
| Cp,gas | 1248.50 | J/mol×K | 938.53 | Joback Calculated Property |
| Cp,gas | 1267.78 | J/mol×K | 974.17 | Joback Calculated Property |
| Cp,gas | 1285.57 | J/mol×K | 1009.81 | Joback Calculated Property |
| Cp,gas | 1301.90 | J/mol×K | 1045.44 | Joback Calculated Property |
| Cp,gas | 1316.83 | J/mol×K | 1081.08 | Joback Calculated Property |
| Cp,gas | 1330.39 | J/mol×K | 1116.72 | Joback Calculated Property |
| Cp,gas | 1342.63 | J/mol×K | 1152.36 | Joback Calculated Property |
| η | [0.0000247; 0.0004067] | Pa×s | [534.48; 938.53] |
|
| η | 0.0004067 | Pa×s | 534.48 | Joback Calculated Property |
| η | 0.0001963 | Pa×s | 601.82 | Joback Calculated Property |
| η | 0.0001097 | Pa×s | 669.16 | Joback Calculated Property |
| η | 0.0000682 | Pa×s | 736.50 | Joback Calculated Property |
| η | 0.0000459 | Pa×s | 803.85 | Joback Calculated Property |
| η | 0.0000329 | Pa×s | 871.19 | Joback Calculated Property |
| η | 0.0000247 | Pa×s | 938.53 | Joback Calculated Property |
Similar Compounds
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Sources
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