- InChI
- InChI=1S/C18H30O4/c1-3-5-6-7-10-14-22-18(20)16-12-9-8-11-15(16)17(19)21-13-4-2/h4,15-16H,2-3,5-14H2,1H3
- InChI Key
- SQCHRHSVUHSXTL-UHFFFAOYSA-N
- Formula
- C18H30O4
- SMILES
-
C=CCOC(=O)C1CCCCC1C(=O)OCCCCCC
C - Molecular Weight1
- 310.43
- 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° | -262.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -745.04 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.42 | kJ/mol | Joback Calculated Property |
| log10WS | -4.35 | Crippen Calculated Property | |
| logPoct/wat | 4.036 | Crippen Calculated Property | |
| McVol | 264.200 | ml/mol | McGowan Calculated Property |
| Pc | 1434.80 | kPa | Joback Calculated Property |
| Inp | [2118.00; 2118.00] |
|
|
| Inp | 2118.00 | NIST | |
| Inp | 2118.00 | NIST | |
| Tboil | 775.38 | K | Joback Calculated Property |
| Tc | 971.91 | K | Joback Calculated Property |
| Tfus | 438.32 | K | Joback Calculated Property |
| Vc | 1.004 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [822.59; 916.25] | J/mol×K | [775.38; 971.91] |
|
| Cp,gas | 822.59 | J/mol×K | 775.38 | Joback Calculated Property |
| Cp,gas | 841.18 | J/mol×K | 808.14 | Joback Calculated Property |
| Cp,gas | 858.55 | J/mol×K | 840.89 | Joback Calculated Property |
| Cp,gas | 874.73 | J/mol×K | 873.65 | Joback Calculated Property |
| Cp,gas | 889.73 | J/mol×K | 906.40 | Joback Calculated Property |
| Cp,gas | 903.57 | J/mol×K | 939.16 | Joback Calculated Property |
| Cp,gas | 916.25 | J/mol×K | 971.91 | Joback Calculated Property |
| η | [0.0000984; 0.0012385] | Pa×s | [438.32; 775.38] |
|
| η | 0.0012385 | Pa×s | 438.32 | Joback Calculated Property |
| η | 0.0006390 | Pa×s | 494.50 | Joback Calculated Property |
| η | 0.0003773 | Pa×s | 550.67 | Joback Calculated Property |
| η | 0.0002457 | Pa×s | 606.85 | Joback Calculated Property |
| η | 0.0001720 | Pa×s | 663.03 | Joback Calculated Property |
| η | 0.0001273 | Pa×s | 719.20 | Joback Calculated Property |
| η | 0.0000984 | Pa×s | 775.38 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, allyl heptyl ester.
Sources
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