- InChI
- InChI=1S/C28H38Cl2O4/c1-4-7-8-9-10-11-12-13-16-19-33-26(31)28(5-2,6-3)27(32)34-25-22-18-15-14-17-21(22)23(29)20-24(25)30/h14-15,17-18,20H,4-13,16,19H2,1-3H3
- InChI Key
- ODTJGKPISYMQJS-UHFFFAOYSA-N
- Formula
- C28H38Cl2O4
- SMILES
-
CCCCCCCCCCCOC(=O)C(CC)(CC)C(=O
)Oc1c(Cl)cc(Cl)c2ccccc12 - Molecular Weight1
- 509.50
- 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° | -113.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -757.89 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 64.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.61 | kJ/mol | Joback Calculated Property |
| log10WS | -10.28 | Crippen Calculated Property | |
| logPoct/wat | 8.932 | Crippen Calculated Property | |
| McVol | 401.520 | ml/mol | McGowan Calculated Property |
| Pc | 897.49 | kPa | Joback Calculated Property |
| Inp | [3474.00; 3474.00] |
|
|
| Inp | 3474.00 | NIST | |
| Inp | 3474.00 | NIST | |
| Tboil | 1124.85 | K | Joback Calculated Property |
| Tc | 1379.37 | K | Joback Calculated Property |
| Tfus | 708.58 | K | Joback Calculated Property |
| Vc | 1.552 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1330.36; 1406.00] | J/mol×K | [1124.85; 1379.37] |
|
| Cp,gas | 1330.36 | J/mol×K | 1124.85 | Joback Calculated Property |
| Cp,gas | 1345.30 | J/mol×K | 1167.27 | Joback Calculated Property |
| Cp,gas | 1359.11 | J/mol×K | 1209.69 | Joback Calculated Property |
| Cp,gas | 1371.94 | J/mol×K | 1252.11 | Joback Calculated Property |
| Cp,gas | 1383.94 | J/mol×K | 1294.53 | Joback Calculated Property |
| Cp,gas | 1395.24 | J/mol×K | 1336.95 | Joback Calculated Property |
| Cp,gas | 1406.00 | J/mol×K | 1379.37 | Joback Calculated Property |
| η | [0.0000197; 0.0001470] | Pa×s | [708.58; 1124.85] |
|
| η | 0.0001470 | Pa×s | 708.58 | Joback Calculated Property |
| η | 0.0000906 | Pa×s | 777.96 | Joback Calculated Property |
| η | 0.0000604 | Pa×s | 847.34 | Joback Calculated Property |
| η | 0.0000428 | Pa×s | 916.71 | Joback Calculated Property |
| η | 0.0000319 | Pa×s | 986.09 | Joback Calculated Property |
| η | 0.0000247 | Pa×s | 1055.47 | Joback Calculated Property |
| η | 0.0000197 | Pa×s | 1124.85 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2,4-dichloronaphth-1-yl undecyl ester.
Sources
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