- InChI
- InChI=1S/C20H22O4/c21-19(23-15-17-9-3-1-4-10-17)13-7-8-14-20(22)24-16-18-11-5-2-6-12-18/h1-6,9-12H,7-8,13-16H2
- InChI Key
- AEUORZZHALJMBM-UHFFFAOYSA-N
- Formula
- C20H22O4
- SMILES
-
O=C(CCCCC(=O)OCc1ccccc1)OCc1cc
ccc1 - Molecular Weight1
- 326.39
- CAS
- 2451-84-5
- Other Names
-
- dibenzyl adipate
- 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° | -125.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -472.67 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.98 | kJ/mol | Joback Calculated Property |
| log10WS | -5.12 | Crippen Calculated Property | |
| logPoct/wat | 4.034 | Crippen Calculated Property | |
| McVol | 260.020 | ml/mol | McGowan Calculated Property |
| Pc | 1759.49 | kPa | Joback Calculated Property |
| Inp | 2616.00 | NIST | |
| Tboil | 862.94 | K | Joback Calculated Property |
| Tc | 1085.96 | K | Joback Calculated Property |
| Tfus | 512.32 | K | Joback Calculated Property |
| Vc | 0.988 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [782.60; 850.18] | J/mol×K | [862.94; 1085.96] | 
|
| Cp,gas | 782.60 | J/mol×K | 862.94 | Joback Calculated Property |
| Cp,gas | 796.90 | J/mol×K | 900.11 | Joback Calculated Property |
| Cp,gas | 809.92 | J/mol×K | 937.28 | Joback Calculated Property |
| Cp,gas | 821.72 | J/mol×K | 974.45 | Joback Calculated Property |
| Cp,gas | 832.33 | J/mol×K | 1011.62 | Joback Calculated Property |
| Cp,gas | 841.80 | J/mol×K | 1048.79 | Joback Calculated Property |
| Cp,gas | 850.18 | J/mol×K | 1085.96 | Joback Calculated Property |
| η | [0.0000553; 0.0005956] | Pa×s | [512.32; 862.94] |
|
| η | 0.0005956 | Pa×s | 512.32 | Joback Calculated Property |
| η | 0.0003272 | Pa×s | 570.76 | Joback Calculated Property |
| η | 0.0002009 | Pa×s | 629.19 | Joback Calculated Property |
| η | 0.0001340 | Pa×s | 687.63 | Joback Calculated Property |
| η | 0.0000953 | Pa×s | 746.07 | Joback Calculated Property |
| η | 0.0000712 | Pa×s | 804.50 | Joback Calculated Property |
| η | 0.0000553 | Pa×s | 862.94 | Joback Calculated Property |
Similar Compounds
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Sources
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