- InChI
- InChI=1S/C19H24ClF3O4/c20-12-5-3-1-2-4-6-13-26-16(24)8-7-9-17(25)27-15-11-10-14(21)18(22)19(15)23/h10-11H,1-9,12-13H2
- InChI Key
- SCDLIKGDRXURBP-UHFFFAOYSA-N
- Formula
- C19H24ClF3O4
- SMILES
-
O=C(CCCC(=O)Oc1ccc(F)c(F)c1F)O
CCCCCCCCCl - Molecular Weight1
- 408.84
- 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 | 1.0427 | Relay (1.0) Calculated Property | |
| ΔfG° | -871.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1326.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 56.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.91 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.12 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.35 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.302 | Crippen Calculated Property | |
| McVol | 287.240 | ml/mol | McGowan Calculated Property |
| Pc | 1243.33 | kPa | Joback Calculated Property |
| Inp | 2624.00 | NIST | |
| Tboil | 629.85 | K | Relay (1.0) Calculated Property |
| Tc | 830.02 | K | Relay (1.0) Calculated Property |
| Tfus | 307.70 | K | Relay (1.0) Calculated Property |
| Vc | 1.063 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [866.46; 932.99] | J/mol×K | [863.56; 1060.18] | 
|
| Cp,gas | 866.46 | J/mol×K | 863.56 | Joback Calculated Property |
| Cp,gas | 880.07 | J/mol×K | 896.33 | Joback Calculated Property |
| Cp,gas | 892.66 | J/mol×K | 929.10 | Joback Calculated Property |
| Cp,gas | 904.23 | J/mol×K | 961.87 | Joback Calculated Property |
| Cp,gas | 914.80 | J/mol×K | 994.64 | Joback Calculated Property |
| Cp,gas | 924.38 | J/mol×K | 1027.41 | Joback Calculated Property |
| Cp,gas | 932.99 | J/mol×K | 1060.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 8-chlorooctyl 2,3,4-trifluorophenyl ester.
Sources
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