- InChI
- InChI=1S/C27H50O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27(29)25-26(2)28/h10-11H,3-9,12-25H2,1-2H3/b11-10-
- InChI Key
- JOPYJNRQQOWTHX-KHPPLWFESA-N
- Formula
- C27H50O2
- SMILES
-
CCCCCCCCC=CCCCCCCCCCCCCCC(=O)C
C(C)=O - Molecular Weight1
- 406.68
- CAS
- 305805-38-3
- 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° | -1.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -708.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 69.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.15 | kJ/mol | Joback Calculated Property |
| log10WS | -9.54 | Crippen Calculated Property | |
| logPoct/wat | 8.913 | Crippen Calculated Property | |
| McVol | 390.130 | ml/mol | McGowan Calculated Property |
| Pc | 758.07 | kPa | Joback Calculated Property |
| Inp | [3021.20; 3021.20] |
|
|
| Inp | 3021.20 | NIST | |
| Inp | 3021.20 | NIST | |
| Tboil | 929.06 | K | Joback Calculated Property |
| Tc | 1140.18 | K | Joback Calculated Property |
| Tfus | 488.83 | K | Joback Calculated Property |
| Vc | 1.540 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1316.92; 1431.04] | J/mol×K | [929.06; 1140.18] |
|
| Cp,gas | 1316.92 | J/mol×K | 929.06 | Joback Calculated Property |
| Cp,gas | 1338.80 | J/mol×K | 964.25 | Joback Calculated Property |
| Cp,gas | 1359.42 | J/mol×K | 999.43 | Joback Calculated Property |
| Cp,gas | 1378.86 | J/mol×K | 1034.62 | Joback Calculated Property |
| Cp,gas | 1397.22 | J/mol×K | 1069.81 | Joback Calculated Property |
| Cp,gas | 1414.59 | J/mol×K | 1104.99 | Joback Calculated Property |
| Cp,gas | 1431.04 | J/mol×K | 1140.18 | Joback Calculated Property |
| η | [0.0000298; 0.0007463] | Pa×s | [488.83; 929.06] |
|
| η | 0.0007463 | Pa×s | 488.83 | Joback Calculated Property |
| η | 0.0003075 | Pa×s | 562.20 | Joback Calculated Property |
| η | 0.0001555 | Pa×s | 635.57 | Joback Calculated Property |
| η | 0.0000905 | Pa×s | 708.94 | Joback Calculated Property |
| η | 0.0000583 | Pa×s | 782.32 | Joback Calculated Property |
| η | 0.0000405 | Pa×s | 855.69 | Joback Calculated Property |
| η | 0.0000298 | Pa×s | 929.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (Z)-Heptacos-18-ene-2,4-dione.
Sources
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