- InChI
- InChI=1S/C19H27ClO4/c1-5-8-9-12-23-17(21)19(6-2,7-3)18(22)24-16-13-14(4)10-11-15(16)20/h10-11,13H,5-9,12H2,1-4H3
- InChI Key
- HDMLRBKBZYBXEN-UHFFFAOYSA-N
- Formula
- C19H27ClO4
- SMILES
-
CCCCCOC(=O)C(CC)(CC)C(=O)Oc1cc
(C)ccc1Cl - Molecular Weight1
- 354.87
- 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° | -274.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -735.99 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.89 | kJ/mol | Joback Calculated Property |
| log10WS | -5.75 | Crippen Calculated Property | |
| logPoct/wat | 5.094 | Crippen Calculated Property | |
| McVol | 281.930 | ml/mol | McGowan Calculated Property |
| Pc | 1405.90 | kPa | Joback Calculated Property |
| Inp | 2245.00 | NIST | |
| Tboil | 857.54 | K | Joback Calculated Property |
| Tc | 1068.20 | K | Joback Calculated Property |
| Tfus | 532.01 | K | Joback Calculated Property |
| Vc | 1.077 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [846.41; 919.23] | J/mol×K | [857.54; 1068.20] | 
|
| Cp,gas | 846.41 | J/mol×K | 857.54 | Joback Calculated Property |
| Cp,gas | 861.22 | J/mol×K | 892.65 | Joback Calculated Property |
| Cp,gas | 874.92 | J/mol×K | 927.76 | Joback Calculated Property |
| Cp,gas | 887.53 | J/mol×K | 962.87 | Joback Calculated Property |
| Cp,gas | 899.09 | J/mol×K | 997.98 | Joback Calculated Property |
| Cp,gas | 909.65 | J/mol×K | 1033.09 | Joback Calculated Property |
| Cp,gas | 919.23 | J/mol×K | 1068.20 | Joback Calculated Property |
| η | [0.0000435; 0.0004205] | Pa×s | [532.01; 857.54] |
|
| η | 0.0004205 | Pa×s | 532.01 | Joback Calculated Property |
| η | 0.0002419 | Pa×s | 586.26 | Joback Calculated Property |
| η | 0.0001528 | Pa×s | 640.52 | Joback Calculated Property |
| η | 0.0001037 | Pa×s | 694.77 | Joback Calculated Property |
| η | 0.0000745 | Pa×s | 749.03 | Joback Calculated Property |
| η | 0.0000559 | Pa×s | 803.28 | Joback Calculated Property |
| η | 0.0000435 | Pa×s | 857.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2-chloro-5-methylphenyl pentyl ester.
Sources
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