- InChI
- InChI=1S/C10H11F7O2/c1-2-3-4-5-6-19-7(18)8(11,12)9(13,14)10(15,16)17/h3-4H,2,5-6H2,1H3/b4-3-
- InChI Key
- IIKAVGQGNAGAMG-ARJAWSKDSA-N
- Formula
- C10H11F7O2
- SMILES
-
CCC=CCCOC(=O)C(F)(F)C(F)(F)C(F
)(F)F - Molecular Weight1
- 296.18
- 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 | 0.4857 | Relay (1.0) Calculated Property | |
| ΔfG° | -1475.53 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1897.15 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.42 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.15 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.46 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.719 | Crippen Calculated Property | |
| McVol | 167.290 | ml/mol | McGowan Calculated Property |
| Pc | 1829.41 | kPa | Joback Calculated Property |
| Inp | [929.00; 929.00] |
|
|
| Inp | 929.00 | NIST | |
| Inp | 929.00 | NIST | |
| Tboil | 421.10 | K | Relay (1.0) Calculated Property |
| Tc | 542.89 | K | Relay (1.0) Calculated Property |
| Tfus | 193.98 | K | Relay (1.0) Calculated Property |
| Vc | 0.604 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [417.08; 482.07] | J/mol×K | [493.85; 647.78] |
|
| Cp,gas | 417.08 | J/mol×K | 493.85 | Joback Calculated Property |
| Cp,gas | 429.65 | J/mol×K | 519.50 | Joback Calculated Property |
| Cp,gas | 441.48 | J/mol×K | 545.16 | Joback Calculated Property |
| Cp,gas | 452.60 | J/mol×K | 570.81 | Joback Calculated Property |
| Cp,gas | 463.05 | J/mol×K | 596.47 | Joback Calculated Property |
| Cp,gas | 472.86 | J/mol×K | 622.12 | Joback Calculated Property |
| Cp,gas | 482.07 | J/mol×K | 647.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-3-Hexen-1-ol, heptafluorobutyrate.
Sources
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