- InChI
- InChI=1S/C14H19F7O2/c1-7(2)9-5-4-8(3)6-10(9)23-11(22)12(15,16)13(17,18)14(19,20)21/h7-10H,4-6H2,1-3H3/t8-,9+,10-/m0/s1
- InChI Key
- HXIYDRJIRXBMIU-AEJSXWLSSA-N
- Formula
- C14H19F7O2
- SMILES
-
CC1CCC(C(C)C)C(OC(=O)C(F)(F)C(
F)(F)C(F)(F)F)C1 - Molecular Weight1
- 352.29
- 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° | -1515.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1967.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.73 | kJ/mol | Joback Calculated Property |
| log10WS | -5.12 | Crippen Calculated Property | |
| logPoct/wat | 4.823 | Crippen Calculated Property | |
| McVol | 217.090 | ml/mol | McGowan Calculated Property |
| Pc | 1449.04 | kPa | Joback Calculated Property |
| Inp | 1200.00 | NIST | |
| Tboil | 590.98 | K | Joback Calculated Property |
| Tc | 762.61 | K | Joback Calculated Property |
| Tfus | 314.99 | K | Joback Calculated Property |
| Vc | 0.862 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [625.94; 720.48] | J/mol×K | [590.98; 762.61] | 
|
| Cp,gas | 625.94 | J/mol×K | 590.98 | Joback Calculated Property |
| Cp,gas | 644.24 | J/mol×K | 619.58 | Joback Calculated Property |
| Cp,gas | 661.47 | J/mol×K | 648.19 | Joback Calculated Property |
| Cp,gas | 677.66 | J/mol×K | 676.79 | Joback Calculated Property |
| Cp,gas | 692.87 | J/mol×K | 705.40 | Joback Calculated Property |
| Cp,gas | 707.13 | J/mol×K | 734.00 | Joback Calculated Property |
| Cp,gas | 720.48 | J/mol×K | 762.61 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Menthol, heptafluorobutanoate.
Sources
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