- InChI
- InChI=1S/C11H24/c1-4-7-10-11(8-5-2)9-6-3/h11H,4-10H2,1-3H3
- InChI Key
- VFAMBAFLNKONTN-UHFFFAOYSA-N
- Formula
- C11H24
- SMILES
- CCCCC(CCC)CCC
- Molecular Weight1
- 156.31
- CAS
- 17302-13-5
- Other Names
-
- 4-propyloctane
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- Pvap : Vapor 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 | 0.4805 | Relay (1.0) Calculated Property | |
| ΔfG° | 39.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -262.50 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 20.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.66 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.36 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.02 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.393 | Crippen Calculated Property | |
| McVol | 165.850 | ml/mol | McGowan Calculated Property |
| Pc | 1947.51 | kPa | Joback Calculated Property |
| Inp | 1029.00 | NIST | |
| Tboil | 448.00 ± 4.00 | K | NIST |
| Tc | 625.36 | K | Relay (1.0) Calculated Property |
| Tfus | 187.64 | K | Relay (1.0) Calculated Property |
| Vc | 0.616 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [360.10; 449.44] | J/mol×K | [450.64; 615.77] | 
|
| Cp,gas | 360.10 | J/mol×K | 450.64 | Joback Calculated Property |
| Cp,gas | 376.48 | J/mol×K | 478.16 | Joback Calculated Property |
| Cp,gas | 392.24 | J/mol×K | 505.68 | Joback Calculated Property |
| Cp,gas | 407.41 | J/mol×K | 533.20 | Joback Calculated Property |
| Cp,gas | 421.98 | J/mol×K | 560.73 | Joback Calculated Property |
| Cp,gas | 435.99 | J/mol×K | 588.25 | Joback Calculated Property |
| Cp,gas | 449.44 | J/mol×K | 615.77 | Joback Calculated Property |
| η | [0.0002156; 0.0105797] | Pa×s | [198.73; 450.64] |
|
| η | 0.0105797 | Pa×s | 198.73 | Joback Calculated Property |
| η | 0.0031400 | Pa×s | 240.72 | Joback Calculated Property |
| η | 0.0013369 | Pa×s | 282.70 | Joback Calculated Property |
| η | 0.0007098 | Pa×s | 324.69 | Joback Calculated Property |
| η | 0.0004357 | Pa×s | 366.67 | Joback Calculated Property |
| η | 0.0002956 | Pa×s | 408.65 | Joback Calculated Property |
| η | 0.0002156 | Pa×s | 450.64 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [338.03; 482.08] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.41201e+01 | |||
| Coefficient B | -3.49380e+03 | |||
| Coefficient C | -8.54500e+01 | |||
| Temperature range, min. | 338.03 | |||
| Temperature range, max. | 482.08 | |||
| Pvap | 1.33 | kPa | 338.03 | Calculated Property |
| Pvap | 3.04 | kPa | 354.04 | Calculated Property |
| Pvap | 6.32 | kPa | 370.04 | Calculated Property |
| Pvap | 12.15 | kPa | 386.05 | Calculated Property |
| Pvap | 21.86 | kPa | 402.05 | Calculated Property |
| Pvap | 37.18 | kPa | 418.06 | Calculated Property |
| Pvap | 60.23 | kPa | 434.06 | Calculated Property |
| Pvap | 93.51 | kPa | 450.07 | Calculated Property |
| Pvap | 139.90 | kPa | 466.07 | Calculated Property |
| Pvap | 202.63 | kPa | 482.08 | Calculated Property |
Similar Compounds
Find more compounds similar to Octane, 4-propyl-.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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