- InChI
- InChI=1S/C18H32O4/c1-3-5-15-21-17(19)13-11-9-7-8-10-12-14-18(20)22-16-6-4-2/h3H,1,4-16H2,2H3
- InChI Key
- CFQRQXCPTSJENS-UHFFFAOYSA-N
- Formula
- C18H32O4
- SMILES
- C=CCCOC(=O)CCCCCCCCC(=O)OCCCC
- Molecular Weight1
- 312.44
- 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 | 0.9314 | Relay (... Calculated Property | |
| ΔfG° | -279.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -923.64 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 46.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.09 | kJ/mol | Relay (... Calculated Property |
| IE | 9.38 | eV | Relay (... Calculated Property |
| log10WS | -4.36 | Relay (... Calculated Property | |
| logPoct/wat | 4.570 | Crippen Calculated Property | |
| McVol | 275.060 | ml/mol | McGowan Calculated Property |
| Pc | 1264.65 | kPa | Joback Calculated Property |
| Inp | [2131.00; 2131.00] |
|
|
| Inp | 2131.00 | NIST | |
| Inp | 2131.00 | NIST | |
| Tboil | 617.71 | K | Relay (... Calculated Property |
| Tc | 769.10 | K | Relay (... Calculated Property |
| Tfus | 253.36 | K | Relay (... Calculated Property |
| Vc | 1.037 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [823.69; 911.85] | J/mol×K | [760.50; 940.16] |
|
| Cp,gas | 823.69 | J/mol×K | 760.50 | Joback Calculated Property |
| Cp,gas | 840.57 | J/mol×K | 790.44 | Joback Calculated Property |
| Cp,gas | 856.55 | J/mol×K | 820.39 | Joback Calculated Property |
| Cp,gas | 871.66 | J/mol×K | 850.33 | Joback Calculated Property |
| Cp,gas | 885.90 | J/mol×K | 880.27 | Joback Calculated Property |
| Cp,gas | 899.29 | J/mol×K | 910.22 | Joback Calculated Property |
| Cp,gas | 911.85 | J/mol×K | 940.16 | Joback Calculated Property |
| η | [0.0000751; 0.0010429] | Pa×s | [435.18; 760.50] |
|
| η | 0.0010429 | Pa×s | 435.18 | Joback Calculated Property |
| η | 0.0005276 | Pa×s | 489.40 | Joback Calculated Property |
| η | 0.0003058 | Pa×s | 543.62 | Joback Calculated Property |
| η | 0.0001956 | Pa×s | 597.84 | Joback Calculated Property |
| η | 0.0001348 | Pa×s | 652.06 | Joback Calculated Property |
| η | 0.0000984 | Pa×s | 706.28 | Joback Calculated Property |
| η | 0.0000751 | Pa×s | 760.50 | Joback Calculated Property |
Similar Compounds
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Sources
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