- InChI
- InChI=1S/C24H38O6/c1-19(2)13-12-18-29-22(25)16-9-7-5-6-8-10-17-23(26)30-24-20(27-3)14-11-15-21(24)28-4/h11,14-15,19H,5-10,12-13,16-18H2,1-4H3
- InChI Key
- GBCUGJJTZUGPIS-UHFFFAOYSA-N
- Formula
- C24H38O6
- SMILES
-
COc1cccc(OC)c1OC(=O)CCCCCCCCC(
=O)OCCCC(C)C - Molecular Weight1
- 422.55
- 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 | 1.1914 | Relay (1.0) Calculated Property | |
| ΔfG° | -435.93 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1157.39 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 55.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 115.50 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.15 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.40 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.709 | Crippen Calculated Property | |
| McVol | 351.880 | ml/mol | McGowan Calculated Property |
| Pc | 1004.62 | kPa | Joback Calculated Property |
| Inp | 3107.00 | NIST | |
| Tboil | 676.62 | K | Relay (1.0) Calculated Property |
| Tc | 874.97 | K | Relay (1.0) Calculated Property |
| Tfus | 333.45 | K | Relay (1.0) Calculated Property |
| Vc | 1.313 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1177.79; 1243.14] | J/mol×K | [982.14; 1202.53] | 
|
| Cp,gas | 1177.79 | J/mol×K | 982.14 | Joback Calculated Property |
| Cp,gas | 1193.14 | J/mol×K | 1018.87 | Joback Calculated Property |
| Cp,gas | 1206.71 | J/mol×K | 1055.60 | Joback Calculated Property |
| Cp,gas | 1218.48 | J/mol×K | 1092.34 | Joback Calculated Property |
| Cp,gas | 1228.48 | J/mol×K | 1129.07 | Joback Calculated Property |
| Cp,gas | 1236.69 | J/mol×K | 1165.80 | Joback Calculated Property |
| Cp,gas | 1243.14 | J/mol×K | 1202.53 | Joback Calculated Property |
| η | [0.0000157; 0.0001776] | Pa×s | [585.48; 982.14] |
|
| η | 0.0001776 | Pa×s | 585.48 | Joback Calculated Property |
| η | 0.0000965 | Pa×s | 651.59 | Joback Calculated Property |
| η | 0.0000587 | Pa×s | 717.70 | Joback Calculated Property |
| η | 0.0000388 | Pa×s | 783.81 | Joback Calculated Property |
| η | 0.0000274 | Pa×s | 849.92 | Joback Calculated Property |
| η | 0.0000203 | Pa×s | 916.03 | Joback Calculated Property |
| η | 0.0000157 | Pa×s | 982.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, 2,6-dimethoxyphenyl isohexyl ester.
Sources
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