- InChI
- InChI=1S/C25H42/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/h9,12-13,17,22,25H,1,8,10-11,14-16,18-19H2,2-7H3/b23-17+
- InChI Key
- VLXSQAFKTICBAS-HAVVHWLPSA-N
- Formula
- C25H42
- SMILES
-
C=CC(C)CCC(CC=C(C)CCC=C(C)C)C(
=C)CCC=C(C)C - Molecular Weight1
- 342.60
- 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° | 536.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -6.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.32 | kJ/mol | Joback Calculated Property |
| log10WS | -9.07 | Crippen Calculated Property | |
| logPoct/wat | 8.590 | Crippen Calculated Property | |
| McVol | 341.610 | ml/mol | McGowan Calculated Property |
| Pc | 895.34 | kPa | Joback Calculated Property |
| Inp | 2191.00 | NIST | |
| Tboil | 775.88 | K | Joback Calculated Property |
| Tc | 964.66 | K | Joback Calculated Property |
| Tfus | 266.91 | K | Joback Calculated Property |
| Vc | 1.329 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1026.24; 1141.60] | J/mol×K | [775.88; 964.66] | 
|
| Cp,gas | 1026.24 | J/mol×K | 775.88 | Joback Calculated Property |
| Cp,gas | 1047.70 | J/mol×K | 807.34 | Joback Calculated Property |
| Cp,gas | 1068.16 | J/mol×K | 838.81 | Joback Calculated Property |
| Cp,gas | 1087.69 | J/mol×K | 870.27 | Joback Calculated Property |
| Cp,gas | 1106.38 | J/mol×K | 901.73 | Joback Calculated Property |
| Cp,gas | 1124.32 | J/mol×K | 933.19 | Joback Calculated Property |
| Cp,gas | 1141.60 | J/mol×K | 964.66 | Joback Calculated Property |
Similar Compounds
Sources
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