- InChI
- InChI=1S/C8H15F3/c1-2-3-4-5-6-7-8(9,10)11/h2-7H2,1H3
- InChI Key
- FHMDVJKRMUAZOO-UHFFFAOYSA-N
- Formula
- C8H15F3
- SMILES
- CCCCCCCC(F)(F)F
- Molecular Weight1
- 168.20
- CAS
- 53392-86-2
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -565.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -805.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 29.66 | kJ/mol | Joback Calculated Property |
| log10WS | -3.83 | Crippen Calculated Property | |
| logPoct/wat | 3.909 | Crippen Calculated Property | |
| McVol | 128.890 | ml/mol | McGowan Calculated Property |
| Pc | 2263.26 | kPa | Joback Calculated Property |
| Inp | [720.00; 720.00] |
|
|
| Inp | 720.00 | NIST | |
| Inp | 720.00 | NIST | |
| Tboil | 377.02 | K | Joback Calculated Property |
| Tc | 525.40 | K | Joback Calculated Property |
| Tfus | 184.11 | K | Joback Calculated Property |
| Vc | 0.526 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [257.53; 325.90] | J/mol×K | [377.02; 525.40] |
|
| Cp,gas | 257.53 | J/mol×K | 377.02 | Joback Calculated Property |
| Cp,gas | 270.17 | J/mol×K | 401.75 | Joback Calculated Property |
| Cp,gas | 282.29 | J/mol×K | 426.48 | Joback Calculated Property |
| Cp,gas | 293.91 | J/mol×K | 451.21 | Joback Calculated Property |
| Cp,gas | 305.04 | J/mol×K | 475.94 | Joback Calculated Property |
| Cp,gas | 315.70 | J/mol×K | 500.67 | Joback Calculated Property |
| Cp,gas | 325.90 | J/mol×K | 525.40 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.67] | kPa | [292.95; 454.84] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.27707e+01 | |||
| Coefficient B | -3.00035e+03 | |||
| Coefficient C | -5.26000e+01 | |||
| Temperature range, min. | 292.95 | |||
| Temperature range, max. | 454.84 | |||
| Pvap | 1.33 | kPa | 292.95 | Calculated Property |
| Pvap | 3.18 | kPa | 310.94 | Calculated Property |
| Pvap | 6.77 | kPa | 328.93 | Calculated Property |
| Pvap | 13.15 | kPa | 346.91 | Calculated Property |
| Pvap | 23.65 | kPa | 364.90 | Calculated Property |
| Pvap | 39.91 | kPa | 382.89 | Calculated Property |
| Pvap | 63.80 | kPa | 400.88 | Calculated Property |
| Pvap | 97.41 | kPa | 418.86 | Calculated Property |
| Pvap | 142.93 | kPa | 436.85 | Calculated Property |
| Pvap | 202.67 | kPa | 454.84 | Calculated Property |
Similar Compounds
Find more compounds similar to 1,1,1-Trifluorooctane.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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