- InChI
- InChI=1S/C16H18Cl4O4/c1-2-3-8-23-12(21)6-4-5-7-13(22)24-16-11(18)9-10(17)14(19)15(16)20/h9H,2-8H2,1H3
- InChI Key
- MTGQBSMKIFMBDI-UHFFFAOYSA-N
- Formula
- C16H18Cl4O4
- SMILES
-
CCCCOC(=O)CCCCC(=O)Oc1c(Cl)cc(
Cl)c(Cl)c1Cl - Molecular Weight1
- 416.12
- 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° | -357.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -735.48 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 52.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.99 | kJ/mol | Joback Calculated Property |
| log10WS | -6.74 | Crippen Calculated Property | |
| logPoct/wat | 6.109 | Crippen Calculated Property | |
| McVol | 276.380 | ml/mol | McGowan Calculated Property |
| Pc | 1551.22 | kPa | Joback Calculated Property |
| Inp | 2703.00 | NIST | |
| Tboil | 914.38 | K | Joback Calculated Property |
| Tc | 1134.72 | K | Joback Calculated Property |
| Tfus | 610.58 | K | Joback Calculated Property |
| Vc | 1.067 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [739.79; 785.90] | J/mol×K | [914.38; 1134.72] | 
|
| Cp,gas | 739.79 | J/mol×K | 914.38 | Joback Calculated Property |
| Cp,gas | 750.12 | J/mol×K | 951.10 | Joback Calculated Property |
| Cp,gas | 759.38 | J/mol×K | 987.83 | Joback Calculated Property |
| Cp,gas | 767.59 | J/mol×K | 1024.55 | Joback Calculated Property |
| Cp,gas | 774.74 | J/mol×K | 1061.27 | Joback Calculated Property |
| Cp,gas | 780.84 | J/mol×K | 1097.99 | Joback Calculated Property |
| Cp,gas | 785.90 | J/mol×K | 1134.72 | Joback Calculated Property |
| η | [0.0000555; 0.0002947] | Pa×s | [610.58; 914.38] |
|
| η | 0.0002947 | Pa×s | 610.58 | Joback Calculated Property |
| η | 0.0002006 | Pa×s | 661.21 | Joback Calculated Property |
| η | 0.0001442 | Pa×s | 711.85 | Joback Calculated Property |
| η | 0.0001083 | Pa×s | 762.48 | Joback Calculated Property |
| η | 0.0000843 | Pa×s | 813.11 | Joback Calculated Property |
| η | 0.0000676 | Pa×s | 863.75 | Joback Calculated Property |
| η | 0.0000555 | Pa×s | 914.38 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, butyl 2,3,4,6-tetrachlorophenyl ester.
Sources
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