- InChI
- InChI=1S/C24H36O4/c1-2-3-4-5-6-7-11-17-27-23(25)21-15-12-16-22(18-21)24(26)28-19-20-13-9-8-10-14-20/h12,15-16,18,20H,2-11,13-14,17,19H2,1H3
- InChI Key
- FSDYGECMQKESJK-UHFFFAOYSA-N
- Formula
- C24H36O4
- SMILES
-
CCCCCCCCCOC(=O)c1cccc(C(=O)OCC
2CCCCC2)c1 - Molecular Weight1
- 388.54
- 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 | 1.0456 | Relay (1.0) Calculated Property | |
| ΔfG° | -189.41 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -890.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 48.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 108.77 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.19 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.91 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.331 | Crippen Calculated Property | |
| McVol | 329.280 | ml/mol | McGowan Calculated Property |
| Pc | 1181.71 | kPa | Joback Calculated Property |
| Inp | [3085.00; 3085.00] |
|
|
| Inp | 3085.00 | NIST | |
| Inp | 3085.00 | NIST | |
| Tboil | 699.50 | K | Relay (1.0) Calculated Property |
| Tc | 905.99 | K | Relay (1.0) Calculated Property |
| Tfus | 292.32 | K | Relay (1.0) Calculated Property |
| Vc | 1.220 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1114.62; 1191.57] | J/mol×K | [952.31; 1171.98] |
|
| Cp,gas | 1114.62 | J/mol×K | 952.31 | Joback Calculated Property |
| Cp,gas | 1131.32 | J/mol×K | 988.92 | Joback Calculated Property |
| Cp,gas | 1146.42 | J/mol×K | 1025.53 | Joback Calculated Property |
| Cp,gas | 1159.94 | J/mol×K | 1062.14 | Joback Calculated Property |
| Cp,gas | 1171.94 | J/mol×K | 1098.75 | Joback Calculated Property |
| Cp,gas | 1182.47 | J/mol×K | 1135.36 | Joback Calculated Property |
| Cp,gas | 1191.57 | J/mol×K | 1171.98 | Joback Calculated Property |
| η | [0.0000317; 0.0004314] | Pa×s | [550.88; 952.31] |
|
| η | 0.0004314 | Pa×s | 550.88 | Joback Calculated Property |
| η | 0.0002205 | Pa×s | 617.78 | Joback Calculated Property |
| η | 0.0001285 | Pa×s | 684.69 | Joback Calculated Property |
| η | 0.0000825 | Pa×s | 751.60 | Joback Calculated Property |
| η | 0.0000569 | Pa×s | 818.50 | Joback Calculated Property |
| η | 0.0000415 | Pa×s | 885.40 | Joback Calculated Property |
| η | 0.0000317 | Pa×s | 952.31 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, cyclohexylmethyl nonyl ester.
Sources
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