- InChI
- InChI=1S/C27H50O4/c1-3-5-7-8-9-10-11-12-15-18-21-25-31-27(29)23-20-17-14-13-16-19-22-26(28)30-24-6-4-2/h4H,2-3,5-25H2,1H3
- InChI Key
- KRCBCIOPPZVENH-UHFFFAOYSA-N
- Formula
- C27H50O4
- SMILES
-
C=CCCOC(=O)CCCCCCCCC(=O)OCCCCC
CCCCCCCC - Molecular Weight1
- 438.68
- 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° | -203.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -964.78 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 69.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.34 | kJ/mol | Joback Calculated Property |
| log10WS | -8.70 | Crippen Calculated Property | |
| logPoct/wat | 8.081 | Crippen Calculated Property | |
| McVol | 401.870 | ml/mol | McGowan Calculated Property |
| Pc | 740.03 | kPa | Joback Calculated Property |
| Inp | [3069.00; 3069.00] |
|
|
| Inp | 3069.00 | NIST | |
| Inp | 3069.00 | NIST | |
| Tboil | 966.42 | K | Joback Calculated Property |
| Tc | 1192.80 | K | Joback Calculated Property |
| Tfus | 536.61 | K | Joback Calculated Property |
| Vc | 1.577 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1379.69; 1483.43] | J/mol×K | [966.42; 1192.80] |
|
| Cp,gas | 1379.69 | J/mol×K | 966.42 | Joback Calculated Property |
| Cp,gas | 1401.08 | J/mol×K | 1004.15 | Joback Calculated Property |
| Cp,gas | 1420.75 | J/mol×K | 1041.88 | Joback Calculated Property |
| Cp,gas | 1438.75 | J/mol×K | 1079.61 | Joback Calculated Property |
| Cp,gas | 1455.15 | J/mol×K | 1117.34 | Joback Calculated Property |
| Cp,gas | 1470.03 | J/mol×K | 1155.07 | Joback Calculated Property |
| Cp,gas | 1483.43 | J/mol×K | 1192.80 | Joback Calculated Property |
| η | [0.0000200; 0.0003705] | Pa×s | [536.61; 966.42] |
|
| η | 0.0003705 | Pa×s | 536.61 | Joback Calculated Property |
| η | 0.0001709 | Pa×s | 608.25 | Joback Calculated Property |
| η | 0.0000928 | Pa×s | 679.88 | Joback Calculated Property |
| η | 0.0000566 | Pa×s | 751.52 | Joback Calculated Property |
| η | 0.0000377 | Pa×s | 823.15 | Joback Calculated Property |
| η | 0.0000267 | Pa×s | 894.79 | Joback Calculated Property |
| η | 0.0000200 | Pa×s | 966.42 | Joback Calculated Property |
Similar Compounds
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Sources
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