- InChI
- InChI=1S/C24H46O4/c1-3-5-7-9-11-12-14-18-22-28-24(26)20-16-15-19-23(25)27-21-17-13-10-8-6-4-2/h3-22H2,1-2H3
- InChI Key
- NWSGBTCJMJADLE-UHFFFAOYSA-N
- Formula
- C24H46O4
- SMILES
-
CCCCCCCCCCOC(=O)CCCCC(=O)OCCCC
CCCC - Molecular Weight1
- 398.62
- CAS
- 110-29-2
- Other Names
-
- Hexanedioic acid, decyl octyl ester
- Adipic acid, decyl octyl ester
- Octyl decyl adipate
- 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 | 1.1915 | Relay (1.0) Calculated Property | |
| ΔfG° | -316.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1148.66 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 63.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 114.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.56 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.46 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.134 | Crippen Calculated Property | |
| McVol | 363.900 | ml/mol | McGowan Calculated Property |
| Pc | 849.99 | kPa | Joback Calculated Property |
| Inp | [2745.00; 2745.00] |
|
|
| Inp | 2745.00 | NIST | |
| Inp | 2745.00 | NIST | |
| Inp | 2745.00 | NIST | |
| Tboil | 639.00 | K | Relay (1.0) Calculated Property |
| Tc | 811.76 | K | Relay (1.0) Calculated Property |
| Tfus | 295.35 | K | Relay (1.0) Calculated Property |
| Vc | 1.425 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1217.58; 1318.35] | J/mol×K | [901.10; 1104.70] |
|
| Cp,gas | 1217.58 | J/mol×K | 901.10 | Joback Calculated Property |
| Cp,gas | 1237.78 | J/mol×K | 935.03 | Joback Calculated Property |
| Cp,gas | 1256.57 | J/mol×K | 968.97 | Joback Calculated Property |
| Cp,gas | 1273.99 | J/mol×K | 1002.90 | Joback Calculated Property |
| Cp,gas | 1290.07 | J/mol×K | 1036.83 | Joback Calculated Property |
| Cp,gas | 1304.84 | J/mol×K | 1070.77 | Joback Calculated Property |
| Cp,gas | 1318.35 | J/mol×K | 1104.70 | Joback Calculated Property |
| η | [0.0000294; 0.0005261] | Pa×s | [504.56; 901.10] |
|
| η | 0.0005261 | Pa×s | 504.56 | Joback Calculated Property |
| η | 0.0002463 | Pa×s | 570.65 | Joback Calculated Property |
| η | 0.0001350 | Pa×s | 636.74 | Joback Calculated Property |
| η | 0.0000828 | Pa×s | 702.83 | Joback Calculated Property |
| η | 0.0000553 | Pa×s | 768.92 | Joback Calculated Property |
| η | 0.0000393 | Pa×s | 835.01 | Joback Calculated Property |
| η | 0.0000294 | Pa×s | 901.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Decyl octyl adipate.
Sources
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