- InChI
- InChI=1S/C15H28O4/c1-6-9-10-12(7-2)11-19-14(17)15(4,5)13(16)18-8-3/h12H,6-11H2,1-5H3
- InChI Key
- UAVPSEKGESQSEI-UHFFFAOYSA-N
- Formula
- C15H28O4
- SMILES
-
CCCCC(CC)COC(=O)C(C)(C)C(=O)OC
C - Molecular Weight1
- 272.38
- 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.
- 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 | 0.7009 | Relay (1.0) Calculated Property | |
| ΔfG° | -392.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -986.04 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 29.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.49 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.60 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.79 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.335 | Crippen Calculated Property | |
| McVol | 237.090 | ml/mol | McGowan Calculated Property |
| Pc | 1551.22 | kPa | Joback Calculated Property |
| Inp | [1591.00; 1591.00] |
|
|
| Inp | 1591.00 | NIST | |
| Inp | 1591.00 | NIST | |
| Tboil | 536.59 | K | Relay (1.0) Calculated Property |
| Tc | 720.91 | K | Relay (1.0) Calculated Property |
| Tfus | 210.76 | K | Relay (1.0) Calculated Property |
| Vc | 0.882 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [680.11; 767.65] | J/mol×K | [691.51; 876.12] |
|
| Cp,gas | 680.11 | J/mol×K | 691.51 | Joback Calculated Property |
| Cp,gas | 696.84 | J/mol×K | 722.28 | Joback Calculated Property |
| Cp,gas | 712.70 | J/mol×K | 753.05 | Joback Calculated Property |
| Cp,gas | 727.68 | J/mol×K | 783.82 | Joback Calculated Property |
| Cp,gas | 741.83 | J/mol×K | 814.59 | Joback Calculated Property |
| Cp,gas | 755.14 | J/mol×K | 845.35 | Joback Calculated Property |
| Cp,gas | 767.65 | J/mol×K | 876.12 | Joback Calculated Property |
| η | [0.0000825; 0.0017437] | Pa×s | [390.55; 691.51] |
|
| η | 0.0017437 | Pa×s | 390.55 | Joback Calculated Property |
| η | 0.0007852 | Pa×s | 440.71 | Joback Calculated Property |
| η | 0.0004162 | Pa×s | 490.87 | Joback Calculated Property |
| η | 0.0002481 | Pa×s | 541.03 | Joback Calculated Property |
| η | 0.0001615 | Pa×s | 591.19 | Joback Calculated Property |
| η | 0.0001124 | Pa×s | 641.35 | Joback Calculated Property |
| η | 0.0000825 | Pa×s | 691.51 | Joback Calculated Property |
Similar Compounds
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Sources
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