- InChI
- InChI=1S/C10H16O4/c1-4-14-10(13)9(8(3)12)6-5-7(2)11/h9H,4-6H2,1-3H3
- InChI Key
- FSXQBIOXTYIIDI-UHFFFAOYSA-N
- Formula
- C10H16O4
- SMILES
- CCOC(=O)C(CCC(C)=O)C(C)=O
- Molecular Weight1
- 200.23
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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 | 0.5770 | Relay (1.0) Calculated Property | |
| ΔfG° | -537.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -815.76 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.07 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.14 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.48 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.124 | Crippen Calculated Property | |
| McVol | 162.340 | ml/mol | McGowan Calculated Property |
| Pc | 2405.28 | kPa | Joback Calculated Property |
| Tboil | 524.89 | K | Relay (1.0) Calculated Property |
| Tc | 709.59 | K | Relay (1.0) Calculated Property |
| Tfus | 283.55 | K | Relay (1.0) Calculated Property |
| Vc | 0.575 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [405.12; 472.67] | J/mol×K | [593.92; 783.79] | 
|
| Cp,gas | 405.12 | J/mol×K | 593.92 | Joback Calculated Property |
| Cp,gas | 418.02 | J/mol×K | 625.56 | Joback Calculated Property |
| Cp,gas | 430.25 | J/mol×K | 657.21 | Joback Calculated Property |
| Cp,gas | 441.82 | J/mol×K | 688.85 | Joback Calculated Property |
| Cp,gas | 452.75 | J/mol×K | 720.50 | Joback Calculated Property |
| Cp,gas | 463.03 | J/mol×K | 752.14 | Joback Calculated Property |
| Cp,gas | 472.67 | J/mol×K | 783.79 | Joback Calculated Property |
| η | [0.0002079; 0.0038998] | Pa×s | [329.65; 593.92] |
|
| η | 0.0038998 | Pa×s | 329.65 | Joback Calculated Property |
| η | 0.0017938 | Pa×s | 373.70 | Joback Calculated Property |
| η | 0.0009720 | Pa×s | 417.74 | Joback Calculated Property |
| η | 0.0005919 | Pa×s | 461.78 | Joback Calculated Property |
| η | 0.0003930 | Pa×s | 505.83 | Joback Calculated Property |
| η | 0.0002786 | Pa×s | 549.88 | Joback Calculated Property |
| η | 0.0002079 | Pa×s | 593.92 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexanoic acid, 2-acetyl-5-oxo-, ethyl ester.
Sources
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