- InChI
- InChI=1S/C11H13F7O2/c12-9(13,10(14,15)11(16,17)18)8(19)20-7-5-3-1-2-4-6-7/h7H,1-6H2
- InChI Key
- JHDGOBLRISUXNP-UHFFFAOYSA-N
- Formula
- C11H13F7O2
- SMILES
-
O=C(OC1CCCCCC1)C(F)(F)C(F)(F)C
(F)(F)F - Molecular Weight1
- 310.21
- 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 | 0.4804 | Relay (1.0) Calculated Property | |
| ΔfG° | -1534.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1953.38 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.74 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.73 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.085 | Crippen Calculated Property | |
| McVol | 174.820 | ml/mol | McGowan Calculated Property |
| Pc | 1964.82 | kPa | Joback Calculated Property |
| Inp | [1082.00; 1082.00] |
|
|
| Inp | 1082.00 | NIST | |
| Inp | 1082.00 | NIST | |
| Tboil | 463.48 | K | Relay (1.0) Calculated Property |
| Tc | 612.13 | K | Relay (1.0) Calculated Property |
| Tfus | 230.21 | K | Relay (1.0) Calculated Property |
| Vc | 0.651 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [470.52; 557.05] | J/mol×K | [536.39; 714.81] |
|
| Cp,gas | 470.52 | J/mol×K | 536.39 | Joback Calculated Property |
| Cp,gas | 487.51 | J/mol×K | 566.13 | Joback Calculated Property |
| Cp,gas | 503.42 | J/mol×K | 595.86 | Joback Calculated Property |
| Cp,gas | 518.28 | J/mol×K | 625.60 | Joback Calculated Property |
| Cp,gas | 532.14 | J/mol×K | 655.34 | Joback Calculated Property |
| Cp,gas | 545.05 | J/mol×K | 685.07 | Joback Calculated Property |
| Cp,gas | 557.05 | J/mol×K | 714.81 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cycloheptanol, heptafluorobutyrate.
Sources
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