- InChI
- InChI=1S/C15H8F10O6/c16-12(17,14(20,21)22)10(27)30-6-5-29-9(26)7-3-1-2-4-8(7)31-11(28)13(18,19)15(23,24)25/h1-4H,5-6H2
- InChI Key
- NVQZXNITDHYSQM-UHFFFAOYSA-N
- Formula
- C15H8F10O6
- SMILES
-
O=C(OCCOC(=O)C(F)(F)C(F)(F)F)c
1ccccc1OC(=O)C(F)(F)C(F)(F)F - Molecular Weight1
- 474.20
- 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 | 0.8625 | Relay (1.0) Calculated Property | |
| ΔfG° | -2460.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -3046.12 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 37.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.56 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.94 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.31 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.687 | Crippen Calculated Property | |
| McVol | 238.470 | ml/mol | McGowan Calculated Property |
| Pc | 1504.65 | kPa | Joback Calculated Property |
| Inp | [1477.00; 1477.00] |
|
|
| Inp | 1477.00 | NIST | |
| Inp | 1477.00 | NIST | |
| Tboil | 548.11 | K | Relay (1.0) Calculated Property |
| Tc | 716.60 | K | Relay (1.0) Calculated Property |
| Tfus | 299.12 | K | Relay (1.0) Calculated Property |
| Vc | 0.907 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [720.35; 765.03] | J/mol×K | [782.91; 966.28] |
|
| Cp,gas | 720.35 | J/mol×K | 782.91 | Joback Calculated Property |
| Cp,gas | 729.66 | J/mol×K | 813.47 | Joback Calculated Property |
| Cp,gas | 738.15 | J/mol×K | 844.03 | Joback Calculated Property |
| Cp,gas | 745.87 | J/mol×K | 874.60 | Joback Calculated Property |
| Cp,gas | 752.89 | J/mol×K | 905.16 | Joback Calculated Property |
| Cp,gas | 759.26 | J/mol×K | 935.72 | Joback Calculated Property |
| Cp,gas | 765.03 | J/mol×K | 966.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethylene glycol monosalicylate, bis(pentafluoropropionate).
Sources
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