- InChI
- InChI=1S/C6H12O2.Li/c1-2-3-4-5-6(7)8;/h2-5H2,1H3,(H,7,8);/q;+1/p-1
- InChI Key
- PNDUWCHQCLZPAH-UHFFFAOYSA-M
- Formula
- C6H11LiO2
- SMILES
- CCCCCC(=O)[O-].[Li+]
- Molecular Weight1
- 122.09
- Other Names
-
- lithium caproate
- lithium hexanoate
- ω : Acentric Factor.
- Cp,solid : Solid phase heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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.
- Pc : Critical Pressure (kPa).
- S°solid,1 bar : Solid phase molar entropy at standard conditions (J/mol×K).
- 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 | 0.2654 | Relay (1.0) Calculated Property | |
| ΔfG° | -161.86 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -596.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 46.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.35 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.79 | Relay (1.0) Calculated Property | |
| Pc | 2566.22 | kPa | Relay (1.0-beta) Calculated Property |
| S°solid,1 bar | [228.48; 229.81] | J/mol×K |
|
| S°solid,1 bar | 228.48 | J/mol×K | NIST |
| S°solid,1 bar | 229.81 | J/mol×K | NIST |
| Tboil | 595.06 | K | Relay (1.0) Calculated Property |
| Tc | 878.92 | K | Relay (1.0) Calculated Property |
| Tfus | 560.35 | K | Lithium C1-C12 n-Alkanoates: Thermal behavior from -30C to 600C |
| Vc | 0.340 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,solid | [216.01; 217.01] | J/mol×K | [298.15; 298.15] |
|
| Cp,solid | 216.01 | J/mol×K | 298.15 | NIST |
| Cp,solid | 217.01 | J/mol×K | 298.15 | NIST |
Similar Compounds
Find more compounds similar to Lithium n-hexanoate.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Lithium C1-C12 n-Alkanoates: Thermal behavior from -30C to 600C
- NIST Webbook
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