- InChI
- InChI=1S/C10H20O3/c1-2-3-4-7-10(12)13-9-6-5-8-11/h11H,2-9H2,1H3
- InChI Key
- CXCIGAYDAQVVRU-UHFFFAOYSA-N
- Formula
- C10H20O3
- SMILES
- CCCCCC(=O)OCCCCO
- Molecular Weight1
- 188.26
- 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).
- 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 | 0.8408 | Relay (1.0) Calculated Property | |
| ΔfG° | -337.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -725.13 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.77 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.65 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.882 | Crippen Calculated Property | |
| McVol | 165.070 | ml/mol | McGowan Calculated Property |
| Pc | 2402.92 | kPa | Joback Calculated Property |
| I | 1666.00 | NIST | |
| Tboil | 535.33 | K | Relay (1.0) Calculated Property |
| Tc | 714.24 | K | Relay (1.0) Calculated Property |
| Tfus | 266.37 | K | Relay (1.0) Calculated Property |
| Vc | 0.626 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [428.51; 495.14] | J/mol×K | [596.67; 763.64] | 
|
| Cp,gas | 428.51 | J/mol×K | 596.67 | Joback Calculated Property |
| Cp,gas | 440.83 | J/mol×K | 624.50 | Joback Calculated Property |
| Cp,gas | 452.65 | J/mol×K | 652.33 | Joback Calculated Property |
| Cp,gas | 463.99 | J/mol×K | 680.16 | Joback Calculated Property |
| Cp,gas | 474.85 | J/mol×K | 707.98 | Joback Calculated Property |
| Cp,gas | 485.23 | J/mol×K | 735.81 | Joback Calculated Property |
| Cp,gas | 495.14 | J/mol×K | 763.64 | Joback Calculated Property |
| η | [0.0000771; 0.0060280] | Pa×s | [335.44; 596.67] |
|
| η | 0.0060280 | Pa×s | 335.44 | Joback Calculated Property |
| η | 0.0019204 | Pa×s | 378.98 | Joback Calculated Property |
| η | 0.0007745 | Pa×s | 422.52 | Joback Calculated Property |
| η | 0.0003701 | Pa×s | 466.05 | Joback Calculated Property |
| η | 0.0002006 | Pa×s | 509.59 | Joback Calculated Property |
| η | 0.0001198 | Pa×s | 553.13 | Joback Calculated Property |
| η | 0.0000771 | Pa×s | 596.67 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-hydroxybutyl hexanoate.
Sources
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