- InChI
- InChI=1S/C18H26O5/c1-5-8-13-22-16(19)18(6-2,7-3)17(20)23-15-11-9-14(21-4)10-12-15/h9-12H,5-8,13H2,1-4H3
- InChI Key
- IPSSYSGCYMWQMS-UHFFFAOYSA-N
- Formula
- C18H26O5
- SMILES
-
CCCCOC(=O)C(CC)(CC)C(=O)Oc1ccc
(OC)cc1 - Molecular Weight1
- 322.40
- 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° | -366.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -820.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.03 | kJ/mol | Joback Calculated Property |
| log10WS | -4.29 | Crippen Calculated Property | |
| logPoct/wat | 3.750 | Crippen Calculated Property | |
| McVol | 261.470 | ml/mol | McGowan Calculated Property |
| Pc | 1554.90 | kPa | Joback Calculated Property |
| Inp | [2189.00; 2189.00] |
|
|
| Inp | 2189.00 | NIST | |
| Inp | 2189.00 | NIST | |
| Tboil | 814.67 | K | Joback Calculated Property |
| Tc | 1020.88 | K | Joback Calculated Property |
| Tfus | 500.53 | K | Joback Calculated Property |
| Vc | 0.991 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [791.37; 867.33] | J/mol×K | [814.67; 1020.88] |
|
| Cp,gas | 791.37 | J/mol×K | 814.67 | Joback Calculated Property |
| Cp,gas | 806.81 | J/mol×K | 849.04 | Joback Calculated Property |
| Cp,gas | 821.11 | J/mol×K | 883.41 | Joback Calculated Property |
| Cp,gas | 834.29 | J/mol×K | 917.77 | Joback Calculated Property |
| Cp,gas | 846.37 | J/mol×K | 952.14 | Joback Calculated Property |
| Cp,gas | 857.37 | J/mol×K | 986.51 | Joback Calculated Property |
| Cp,gas | 867.33 | J/mol×K | 1020.88 | Joback Calculated Property |
| η | [0.0000435; 0.0004688] | Pa×s | [500.53; 814.67] |
|
| η | 0.0004688 | Pa×s | 500.53 | Joback Calculated Property |
| η | 0.0002614 | Pa×s | 552.89 | Joback Calculated Property |
| η | 0.0001613 | Pa×s | 605.24 | Joback Calculated Property |
| η | 0.0001075 | Pa×s | 657.60 | Joback Calculated Property |
| η | 0.0000760 | Pa×s | 709.96 | Joback Calculated Property |
| η | 0.0000564 | Pa×s | 762.31 | Joback Calculated Property |
| η | 0.0000435 | Pa×s | 814.67 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, butyl 4-methoxyphenyl ester.
Sources
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