- InChI
- InChI=1S/C14H17F5O4/c1-3-6-10(4-2)23-12(21)8-5-7-11(20)22-9-13(15,16)14(17,18)19/h10H,4-5,7-9H2,1-2H3
- InChI Key
- YSQMZFOHFCXFCP-UHFFFAOYSA-N
- Formula
- C14H17F5O4
- SMILES
-
CC#CC(CC)OC(=O)CCCC(=O)OCC(F)(
F)C(F)(F)F - Molecular Weight1
- 344.27
- 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° | -1168.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1552.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.16 | kJ/mol | Joback Calculated Property |
| log10WS | -4.29 | Crippen Calculated Property | |
| logPoct/wat | 3.243 | Crippen Calculated Property | |
| McVol | 223.250 | ml/mol | McGowan Calculated Property |
| Pc | 1614.17 | kPa | Joback Calculated Property |
| Inp | [1468.00; 1468.00] |
|
|
| Inp | 1468.00 | NIST | |
| Inp | 1468.00 | NIST | |
| Tboil | 670.75 | K | Joback Calculated Property |
| Tc | 848.07 | K | Joback Calculated Property |
| Tfus | 490.75 | K | Joback Calculated Property |
| Vc | 0.891 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [624.42; 693.50] | J/mol×K | [670.75; 848.07] |
|
| Cp,gas | 624.42 | J/mol×K | 670.75 | Joback Calculated Property |
| Cp,gas | 637.77 | J/mol×K | 700.30 | Joback Calculated Property |
| Cp,gas | 650.35 | J/mol×K | 729.86 | Joback Calculated Property |
| Cp,gas | 662.18 | J/mol×K | 759.41 | Joback Calculated Property |
| Cp,gas | 673.30 | J/mol×K | 788.96 | Joback Calculated Property |
| Cp,gas | 683.73 | J/mol×K | 818.51 | Joback Calculated Property |
| Cp,gas | 693.50 | J/mol×K | 848.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, hex-4-yn-3-yl 2,2,3,3,3-pentafluoropropyl ester.
Sources
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