- InChI
- InChI=1S/C20H30O5/c1-5-6-7-9-16(3)24-19(21)10-8-11-20(22)25-18-14-15(2)12-13-17(18)23-4/h12-14,16H,5-11H2,1-4H3
- InChI Key
- JWMOCDZWUCOGJY-UHFFFAOYSA-N
- Formula
- C20H30O5
- SMILES
-
CCCCCC(C)OC(=O)CCCC(=O)Oc1cc(C
)ccc1OC - Molecular Weight1
- 350.45
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -364.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -869.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.05 | kJ/mol | Joback Calculated Property |
| log10WS | -5.54 | Crippen Calculated Property | |
| logPoct/wat | 4.591 | Crippen Calculated Property | |
| McVol | 289.650 | ml/mol | McGowan Calculated Property |
| Pc | 1318.48 | kPa | Joback Calculated Property |
| Inp | [2436.00; 2436.00] |
|
|
| Inp | 2436.00 | NIST | |
| Inp | 2436.00 | NIST | |
| Tboil | 868.20 | K | Joback Calculated Property |
| Tc | 1072.07 | K | Joback Calculated Property |
| Tfus | 518.17 | K | Joback Calculated Property |
| Vc | 1.107 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [906.91; 982.10] | J/mol×K | [868.20; 1072.07] |
|
| Cp,gas | 906.91 | J/mol×K | 868.20 | Joback Calculated Property |
| Cp,gas | 922.55 | J/mol×K | 902.18 | Joback Calculated Property |
| Cp,gas | 936.94 | J/mol×K | 936.16 | Joback Calculated Property |
| Cp,gas | 950.09 | J/mol×K | 970.14 | Joback Calculated Property |
| Cp,gas | 961.99 | J/mol×K | 1004.11 | Joback Calculated Property |
| Cp,gas | 972.66 | J/mol×K | 1038.09 | Joback Calculated Property |
| Cp,gas | 982.10 | J/mol×K | 1072.07 | Joback Calculated Property |
| η | [0.0000382; 0.0004006] | Pa×s | [518.17; 868.20] |
|
| η | 0.0004006 | Pa×s | 518.17 | Joback Calculated Property |
| η | 0.0002221 | Pa×s | 576.51 | Joback Calculated Property |
| η | 0.0001372 | Pa×s | 634.85 | Joback Calculated Property |
| η | 0.0000919 | Pa×s | 693.19 | Joback Calculated Property |
| η | 0.0000655 | Pa×s | 751.52 | Joback Calculated Property |
| η | 0.0000491 | Pa×s | 809.86 | Joback Calculated Property |
| η | 0.0000382 | Pa×s | 868.20 | Joback Calculated Property |
Similar Compounds
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Sources
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