- InChI
- InChI=1S/C27H36Cl2O4/c1-4-7-8-9-10-11-12-15-18-32-25(30)27(5-2,6-3)26(31)33-24-21-17-14-13-16-20(21)22(28)19-23(24)29/h13-14,16-17,19H,4-12,15,18H2,1-3H3
- InChI Key
- LKFIVNZIFASHNK-UHFFFAOYSA-N
- Formula
- C27H36Cl2O4
- SMILES
-
CCCCCCCCCCOC(=O)C(CC)(CC)C(=O)
Oc1c(Cl)cc(Cl)c2ccccc12 - Molecular Weight1
- 495.48
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.1141 | Relay (1.0) Calculated Property | |
| ΔfG° | -122.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -853.33 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 62.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 136.75 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.24 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.03 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.542 | Crippen Calculated Property | |
| McVol | 387.430 | ml/mol | McGowan Calculated Property |
| Pc | 951.42 | kPa | Joback Calculated Property |
| Inp | 3362.00 | NIST | |
| Tboil | 709.24 | K | Relay (1.0) Calculated Property |
| Tc | 988.91 | K | Relay (1.0) Calculated Property |
| Tfus | 359.53 | K | Relay (1.0) Calculated Property |
| Vc | 1.399 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1268.14; 1341.04] | J/mol×K | [1101.97; 1349.63] | 
|
| Cp,gas | 1268.14 | J/mol×K | 1101.97 | Joback Calculated Property |
| Cp,gas | 1282.60 | J/mol×K | 1143.25 | Joback Calculated Property |
| Cp,gas | 1295.97 | J/mol×K | 1184.52 | Joback Calculated Property |
| Cp,gas | 1308.37 | J/mol×K | 1225.80 | Joback Calculated Property |
| Cp,gas | 1319.93 | J/mol×K | 1267.07 | Joback Calculated Property |
| Cp,gas | 1330.77 | J/mol×K | 1308.35 | Joback Calculated Property |
| Cp,gas | 1341.04 | J/mol×K | 1349.63 | Joback Calculated Property |
| η | [0.0000230; 0.0001664] | Pa×s | [697.31; 1101.97] |
|
| η | 0.0001664 | Pa×s | 697.31 | Joback Calculated Property |
| η | 0.0001035 | Pa×s | 764.75 | Joback Calculated Property |
| η | 0.0000695 | Pa×s | 832.20 | Joback Calculated Property |
| η | 0.0000496 | Pa×s | 899.64 | Joback Calculated Property |
| η | 0.0000371 | Pa×s | 967.08 | Joback Calculated Property |
| η | 0.0000288 | Pa×s | 1034.53 | Joback Calculated Property |
| η | 0.0000230 | Pa×s | 1101.97 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, decyl 2,4-dichloronaphth-1-yl ester.
Sources
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