- InChI
- InChI=1S/C28H45ClO5/c1-2-3-4-5-6-9-12-17-22-33-27(30)20-13-10-7-8-11-14-21-28(31)34-24-23-32-26-19-16-15-18-25(26)29/h15-16,18-19H,2-14,17,20-24H2,1H3
- InChI Key
- VLTDRPHWDMDXMZ-UHFFFAOYSA-N
- Formula
- C28H45ClO5
- SMILES
-
CCCCCCCCCCOC(=O)CCCCCCCCC(=O)O
CCOc1ccccc1Cl - Molecular Weight1
- 497.11
- 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° | -297.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1033.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 72.89 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.97 | kJ/mol | Joback Calculated Property |
| log10WS | -8.79 | Crippen Calculated Property | |
| logPoct/wat | 8.067 | Crippen Calculated Property | |
| McVol | 414.610 | ml/mol | McGowan Calculated Property |
| Pc | 792.60 | kPa | Joback Calculated Property |
| Inp | [3322.00; 3322.00] |
|
|
| Inp | 3322.00 | NIST | |
| Inp | 3322.00 | NIST | |
| Tboil | 1084.13 | K | Joback Calculated Property |
| Tc | 1340.28 | K | Joback Calculated Property |
| Tfus | 640.73 | K | Joback Calculated Property |
| Vc | 1.611 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1422.13; 1485.33] | J/mol×K | [1084.13; 1340.28] |
|
| Cp,gas | 1422.13 | J/mol×K | 1084.13 | Joback Calculated Property |
| Cp,gas | 1437.99 | J/mol×K | 1126.82 | Joback Calculated Property |
| Cp,gas | 1451.62 | J/mol×K | 1169.51 | Joback Calculated Property |
| Cp,gas | 1463.10 | J/mol×K | 1212.20 | Joback Calculated Property |
| Cp,gas | 1472.50 | J/mol×K | 1254.89 | Joback Calculated Property |
| Cp,gas | 1479.89 | J/mol×K | 1297.59 | Joback Calculated Property |
| Cp,gas | 1485.33 | J/mol×K | 1340.28 | Joback Calculated Property |
| η | [0.0000102; 0.0001271] | Pa×s | [640.73; 1084.13] |
|
| η | 0.0001271 | Pa×s | 640.73 | Joback Calculated Property |
| η | 0.0000671 | Pa×s | 714.63 | Joback Calculated Property |
| η | 0.0000399 | Pa×s | 788.53 | Joback Calculated Property |
| η | 0.0000260 | Pa×s | 862.43 | Joback Calculated Property |
| η | 0.0000181 | Pa×s | 936.33 | Joback Calculated Property |
| η | 0.0000133 | Pa×s | 1010.23 | Joback Calculated Property |
| η | 0.0000102 | Pa×s | 1084.13 | Joback Calculated Property |
Similar Compounds
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Sources
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