- InChI
- InChI=1S/C7H14O3/c1-3-6(8)5-7(9)10-4-2/h6,8H,3-5H2,1-2H3
- InChI Key
- YESYELHMPYCIAQ-UHFFFAOYSA-N
- Formula
- C7H14O3
- SMILES
- CCOC(=O)CC(O)CC
- Molecular Weight1
- 146.19
- Other Names
-
- Ethyl 3-hydroxypentanoate
- 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).
- Inp : Non-polar retention indices.
- I : 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 | 0.6549 | Relay (1.0) Calculated Property | |
| ΔfG° | -441.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -706.09 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 18.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.03 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.03 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.710 | Crippen Calculated Property | |
| McVol | 122.800 | ml/mol | McGowan Calculated Property |
| Pc | 3138.51 | kPa | Joback Calculated Property |
| Inp | 1129.00 | NIST | |
| I | [1552.00; 1587.00] |
|
|
| I | 1587.00 | NIST | |
| I | 1552.00 | NIST | |
| I | 1552.00 | NIST | |
| I | 1552.00 | NIST | |
| I | 1587.00 | NIST | |
| Tboil | 451.23 | K | Relay (1.0) Calculated Property |
| Tc | 646.28 | K | Relay (1.0) Calculated Property |
| Tfus | 249.56 | K | Relay (1.0) Calculated Property |
| Vc | 0.466 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [285.18; 340.96] | J/mol×K | [509.72; 679.88] |
|
| Cp,gas | 285.18 | J/mol×K | 509.72 | Joback Calculated Property |
| Cp,gas | 295.50 | J/mol×K | 538.08 | Joback Calculated Property |
| Cp,gas | 305.40 | J/mol×K | 566.44 | Joback Calculated Property |
| Cp,gas | 314.90 | J/mol×K | 594.80 | Joback Calculated Property |
| Cp,gas | 323.99 | J/mol×K | 623.16 | Joback Calculated Property |
| Cp,gas | 332.67 | J/mol×K | 651.52 | Joback Calculated Property |
| Cp,gas | 340.96 | J/mol×K | 679.88 | Joback Calculated Property |
| η | [0.0001267; 0.0522625] | Pa×s | [256.80; 509.72] |
|
| η | 0.0522625 | Pa×s | 256.80 | Joback Calculated Property |
| η | 0.0094402 | Pa×s | 298.95 | Joback Calculated Property |
| η | 0.0026029 | Pa×s | 341.11 | Joback Calculated Property |
| η | 0.0009528 | Pa×s | 383.26 | Joback Calculated Property |
| η | 0.0004257 | Pa×s | 425.41 | Joback Calculated Property |
| η | 0.0002199 | Pa×s | 467.57 | Joback Calculated Property |
| η | 0.0001267 | Pa×s | 509.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentanoic acid, 3-hydroxy-, ethyl ester.
Sources
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