- InChI
- InChI=1S/C15H26ClFO4/c16-10-5-3-1-2-4-6-12-20-14(18)8-7-9-15(19)21-13-11-17/h1-13H2
- InChI Key
- NZALLASYAAQGEY-UHFFFAOYSA-N
- Formula
- C15H26ClFO4
- SMILES
- O=C(CCCC(=O)OCCCCCCCCCl)OCCF
- Molecular Weight1
- 324.82
- 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 | 0.9586 | Relay (... Calculated Property | |
| ΔfG° | -599.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1157.93 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 47.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.87 | kJ/mol | Relay (... Calculated Property |
| IE | 9.91 | eV | Relay (... Calculated Property |
| log10WS | -4.13 | Relay (... Calculated Property | |
| logPoct/wat | 3.792 | Crippen Calculated Property | |
| McVol | 251.100 | ml/mol | McGowan Calculated Property |
| Pc | 1426.15 | kPa | Joback Calculated Property |
| Inp | [2206.00; 2206.00] |
|
|
| Inp | 2206.00 | NIST | |
| Inp | 2206.00 | NIST | |
| Tboil | 596.83 | K | Relay (... Calculated Property |
| Tc | 781.25 | K | Relay (... Calculated Property |
| Tfus | 287.67 | K | Relay (... Calculated Property |
| Vc | 0.953 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [715.93; 793.70] | J/mol×K | [731.88; 908.43] |
|
| Cp,gas | 715.93 | J/mol×K | 731.88 | Joback Calculated Property |
| Cp,gas | 730.80 | J/mol×K | 761.30 | Joback Calculated Property |
| Cp,gas | 744.89 | J/mol×K | 790.73 | Joback Calculated Property |
| Cp,gas | 758.22 | J/mol×K | 820.15 | Joback Calculated Property |
| Cp,gas | 770.79 | J/mol×K | 849.58 | Joback Calculated Property |
| Cp,gas | 782.62 | J/mol×K | 879.00 | Joback Calculated Property |
| Cp,gas | 793.70 | J/mol×K | 908.43 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 8-chlorooctyl 2-fluoroethyl ester.
Sources
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