- InChI
- InChI=1S/C25H44/c1-9-22(6)16-18-25(24(8)15-11-13-21(4)5)19-17-23(7)14-10-12-20(2)3/h9,17,20-21,25H,1,6,8,10-16,18-19H2,2-5,7H3/b23-17+
- InChI Key
- FAPXABWJTYQDGU-HAVVHWLPSA-N
- Formula
- C25H44
- SMILES
-
C=CC(=C)CCC(CC=C(C)CCCC(C)C)C(
=C)CCCC(C)C - Molecular Weight1
- 344.62
- 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.
- I : 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° | 470.39 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -111.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.27 | kJ/mol | Joback Calculated Property |
| log10WS | -8.98 | Crippen Calculated Property | |
| logPoct/wat | 8.670 | Crippen Calculated Property | |
| McVol | 345.910 | ml/mol | McGowan Calculated Property |
| Pc | 864.54 | kPa | Joback Calculated Property |
| Inp | [2157.00; 2159.00] |
|
|
| Inp | 2157.00 | NIST | |
| Inp | 2159.00 | NIST | |
| I | 2277.00 | NIST | |
| Tboil | 763.92 | K | Joback Calculated Property |
| Tc | 946.36 | K | Joback Calculated Property |
| Tfus | 274.27 | K | Joback Calculated Property |
| Vc | 1.343 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1048.29; 1165.12] | J/mol×K | [763.92; 946.36] |
|
| Cp,gas | 1048.29 | J/mol×K | 763.92 | Joback Calculated Property |
| Cp,gas | 1070.21 | J/mol×K | 794.33 | Joback Calculated Property |
| Cp,gas | 1091.06 | J/mol×K | 824.73 | Joback Calculated Property |
| Cp,gas | 1110.91 | J/mol×K | 855.14 | Joback Calculated Property |
| Cp,gas | 1129.83 | J/mol×K | 885.54 | Joback Calculated Property |
| Cp,gas | 1147.87 | J/mol×K | 915.95 | Joback Calculated Property |
| Cp,gas | 1165.12 | J/mol×K | 946.36 | Joback Calculated Property |
Similar Compounds
Sources
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