- InChI
- InChI=1S/C9H18/c1-4-6-8-9(3)7-5-2/h3-8H2,1-2H3
- InChI Key
- BWGGEKJMCRHXKX-UHFFFAOYSA-N
- Formula
- C9H18
- SMILES
- C=C(CCC)CCCC
- Molecular Weight1
- 126.24
- 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° | 104.19 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -113.45 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 35.04 | kJ/mol | Joback Calculated Property |
| log10WS | -3.44 | Crippen Calculated Property | |
| logPoct/wat | 3.533 | Crippen Calculated Property | |
| McVol | 133.370 | ml/mol | McGowan Calculated Property |
| Pc | 2414.74 | kPa | Joback Calculated Property |
| Inp | [863.00; 863.00] |
|
|
| Inp | 863.00 | NIST | |
| Inp | 863.00 | NIST | |
| Tboil | 401.88 | K | Joback Calculated Property |
| Tc | 571.36 | K | Joback Calculated Property |
| Tfus | 175.47 | K | Joback Calculated Property |
| Vc | 0.521 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [257.27; 332.43] | J/mol×K | [401.88; 571.36] |
|
| Cp,gas | 257.27 | J/mol×K | 401.88 | Joback Calculated Property |
| Cp,gas | 271.11 | J/mol×K | 430.13 | Joback Calculated Property |
| Cp,gas | 284.40 | J/mol×K | 458.37 | Joback Calculated Property |
| Cp,gas | 297.17 | J/mol×K | 486.62 | Joback Calculated Property |
| Cp,gas | 309.42 | J/mol×K | 514.87 | Joback Calculated Property |
| Cp,gas | 321.16 | J/mol×K | 543.11 | Joback Calculated Property |
| Cp,gas | 332.43 | J/mol×K | 571.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-propyl-1-hexene.
Sources
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