- InChI
- InChI=1S/C32H54O2/c1-9-24(20(2)3)11-10-21(4)26-14-15-28-25-12-13-27-22(5)30(34-23(6)33)17-19-32(27,8)29(25)16-18-31(26,28)7/h12,20-22,24,26-30H,9-11,13-19H2,1-8H3/t21?,22-,24+,26?,27-,28?,29?,30?,31?,32?/m1/s1
- InChI Key
- PGPIOJSFSMAPBR-GBSVDFTQSA-N
- Formula
- C32H54O2
- SMILES
-
CCC(CCC(C)C1CCC2C3=CCC4C(C)C(O
C(C)=O)CCC4(C)C3CCC21C)C(C)C - Molecular Weight1
- 470.77
- 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).
- 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° | 138.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -708.62 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.75 | kJ/mol | Joback Calculated Property |
| log10WS | -9.21 | Crippen Calculated Property | |
| logPoct/wat | 8.842 | Crippen Calculated Property | |
| McVol | 421.440 | ml/mol | McGowan Calculated Property |
| Pc | 773.32 | kPa | Joback Calculated Property |
| Inp | [3451.00; 3451.00] |
|
|
| Inp | 3451.00 | NIST | |
| Inp | 3451.00 | NIST | |
| Tboil | 1040.78 | K | Joback Calculated Property |
| Tc | 1276.11 | K | Joback Calculated Property |
| Tfus | 575.84 | K | Joback Calculated Property |
| Vc | 1.599 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1651.52; 1890.10] | J/mol×K | [1040.78; 1276.11] |
|
| Cp,gas | 1651.52 | J/mol×K | 1040.78 | Joback Calculated Property |
| Cp,gas | 1687.92 | J/mol×K | 1080.00 | Joback Calculated Property |
| Cp,gas | 1725.18 | J/mol×K | 1119.22 | Joback Calculated Property |
| Cp,gas | 1763.66 | J/mol×K | 1158.44 | Joback Calculated Property |
| Cp,gas | 1803.73 | J/mol×K | 1197.67 | Joback Calculated Property |
| Cp,gas | 1845.76 | J/mol×K | 1236.89 | Joback Calculated Property |
| Cp,gas | 1890.10 | J/mol×K | 1276.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 24-Ethyllophenol acetate, 24-«beta».
Sources
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