- InChI
- InChI=1S/C25H38/c1-9-11-12-13-22(6)15-17-25(16-14-21(5)10-2)24(8)19-23(7)18-20(3)4/h9-11,15,18-19,25H,2,5,7,12-14,16-17H2,1,3-4,6,8H3/b11-9+,22-15+,24-19+
- InChI Key
- HSCKENZTIHTETG-XYGPUEHRSA-N
- Formula
- C25H38
- SMILES
-
C=CC(=C)CCC(CC=C(C)CCC=CC)C(C)
=CC(=C)C=C(C)C - Molecular Weight1
- 338.57
- 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 | 0.6125 | Relay (... Calculated Property | |
| ΔfG° | 698.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 22.44 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 47.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.43 | kJ/mol | Relay (... Calculated Property |
| IE | 7.52 | eV | Relay (... Calculated Property |
| log10WS | -7.13 | Relay (... Calculated Property | |
| logPoct/wat | 8.286 | Crippen Calculated Property | |
| McVol | 333.010 | ml/mol | McGowan Calculated Property |
| Pc | 946.16 | kPa | Joback Calculated Property |
| Inp | 2248.00 | NIST | |
| Tboil | 624.59 | K | Relay (... Calculated Property |
| Tc | 792.29 | K | Relay (... Calculated Property |
| Tfus | 263.76 | K | Relay (... Calculated Property |
| Vc | 1.101 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [974.79; 1086.08] | J/mol×K | [777.04; 971.83] | 
|
| Cp,gas | 974.79 | J/mol×K | 777.04 | Joback Calculated Property |
| Cp,gas | 995.35 | J/mol×K | 809.50 | Joback Calculated Property |
| Cp,gas | 1014.96 | J/mol×K | 841.97 | Joback Calculated Property |
| Cp,gas | 1033.73 | J/mol×K | 874.43 | Joback Calculated Property |
| Cp,gas | 1051.76 | J/mol×K | 906.90 | Joback Calculated Property |
| Cp,gas | 1069.18 | J/mol×K | 939.36 | Joback Calculated Property |
| Cp,gas | 1086.08 | J/mol×K | 971.83 | Joback Calculated Property |
Similar Compounds
Sources
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