- InChI
- InChI=1S/C26H44O4/c1-3-4-5-6-7-8-9-20(2)30-25(28)11-10-24(27)29-13-12-26-17-21-14-22(18-26)16-23(15-21)19-26/h20-23H,3-19H2,1-2H3
- InChI Key
- INTQLLOQZJGSNQ-UHFFFAOYSA-N
- Formula
- C26H44O4
- SMILES
-
CCCCCCCCC(C)OC(=O)CCC(=O)OCCC1
2CC3CC(CC(C3)C1)C2 - Molecular Weight1
- 420.63
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | 0.9873 | Relay (... Calculated Property | |
| ΔfG° | -145.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1138.34 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 52.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 124.13 | kJ/mol | Relay (... Calculated Property |
| IE | 9.35 | eV | Relay (... Calculated Property |
| log10WS | -6.82 | Relay (... Calculated Property | |
| logPoct/wat | 6.599 | Crippen Calculated Property | |
| McVol | 359.500 | ml/mol | McGowan Calculated Property |
| Pc | 984.55 | kPa | Joback Calculated Property |
| Inp | 3100.00 | NIST | |
| Tboil | 689.71 | K | Relay (... Calculated Property |
| Tc | 926.26 | K | Relay (... Calculated Property |
| Tfus | 391.81 | K | Relay (... Calculated Property |
| Vc | 1.346 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1308.39; 1456.75] | J/mol×K | [966.48; 1183.80] | 
|
| Cp,gas | 1308.39 | J/mol×K | 966.48 | Joback Calculated Property |
| Cp,gas | 1333.08 | J/mol×K | 1002.70 | Joback Calculated Property |
| Cp,gas | 1357.51 | J/mol×K | 1038.92 | Joback Calculated Property |
| Cp,gas | 1381.90 | J/mol×K | 1075.14 | Joback Calculated Property |
| Cp,gas | 1406.43 | J/mol×K | 1111.36 | Joback Calculated Property |
| Cp,gas | 1431.31 | J/mol×K | 1147.58 | Joback Calculated Property |
| Cp,gas | 1456.75 | J/mol×K | 1183.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2-(adamant-1-yl)ethyl dec-2-yl ester.
Sources
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