- InChI
- InChI=1S/C19H28O5/c1-6-7-10-13-22-17(20)19(4,5)18(21)24-16-12-9-8-11-15(16)23-14(2)3/h8-9,11-12,14H,6-7,10,13H2,1-5H3
- InChI Key
- GDZGYXNMSXIHKC-UHFFFAOYSA-N
- Formula
- C19H28O5
- SMILES
-
CCCCCOC(=O)C(C)(C)C(=O)Oc1cccc
c1OC(C)C - Molecular Weight1
- 336.42
- 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° | -360.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -846.28 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.86 | kJ/mol | Joback Calculated Property |
| log10WS | -4.82 | Crippen Calculated Property | |
| logPoct/wat | 4.139 | Crippen Calculated Property | |
| McVol | 275.560 | ml/mol | McGowan Calculated Property |
| Pc | 1452.35 | kPa | Joback Calculated Property |
| Inp | 2081.00 | NIST | |
| Tboil | 837.11 | K | Joback Calculated Property |
| Tc | 1045.01 | K | Joback Calculated Property |
| Tfus | 496.80 | K | Joback Calculated Property |
| Vc | 1.040 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [849.79; 926.68] | J/mol×K | [837.11; 1045.01] | 
|
| Cp,gas | 849.79 | J/mol×K | 837.11 | Joback Calculated Property |
| Cp,gas | 865.56 | J/mol×K | 871.76 | Joback Calculated Property |
| Cp,gas | 880.10 | J/mol×K | 906.41 | Joback Calculated Property |
| Cp,gas | 893.46 | J/mol×K | 941.06 | Joback Calculated Property |
| Cp,gas | 905.66 | J/mol×K | 975.71 | Joback Calculated Property |
| Cp,gas | 916.72 | J/mol×K | 1010.36 | Joback Calculated Property |
| Cp,gas | 926.68 | J/mol×K | 1045.01 | Joback Calculated Property |
| η | [0.0000344; 0.0004790] | Pa×s | [496.80; 837.11] |
|
| η | 0.0004790 | Pa×s | 496.80 | Joback Calculated Property |
| η | 0.0002466 | Pa×s | 553.52 | Joback Calculated Property |
| η | 0.0001436 | Pa×s | 610.24 | Joback Calculated Property |
| η | 0.0000917 | Pa×s | 666.96 | Joback Calculated Property |
| η | 0.0000628 | Pa×s | 723.67 | Joback Calculated Property |
| η | 0.0000455 | Pa×s | 780.39 | Joback Calculated Property |
| η | 0.0000344 | Pa×s | 837.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, 2-isopropoxyphenyl pentyl ester.
Sources
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