- InChI
- InChI=1S/C16H26O4/c1-11(2)10-19-15(17)13-8-3-4-9-14(13)16(18)20-12-6-5-7-12/h11-14H,3-10H2,1-2H3
- InChI Key
- IMKSHWZMRNELNK-UHFFFAOYSA-N
- Formula
- C16H26O4
- SMILES
-
CC(C)COC(=O)C1CCCCC1C(=O)OC1CC
C1 - Molecular Weight1
- 282.38
- 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° | -321.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -767.83 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.34 | kJ/mol | Joback Calculated Property |
| log10WS | -3.42 | Crippen Calculated Property | |
| logPoct/wat | 3.088 | Crippen Calculated Property | |
| McVol | 229.460 | ml/mol | McGowan Calculated Property |
| Pc | 1846.75 | kPa | Joback Calculated Property |
| Inp | [1917.00; 1917.00] |
|
|
| Inp | 1917.00 | NIST | |
| Inp | 1917.00 | NIST | |
| Tboil | 743.51 | K | Joback Calculated Property |
| Tc | 958.53 | K | Joback Calculated Property |
| Tfus | 416.96 | K | Joback Calculated Property |
| Vc | 0.855 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [720.49; 819.91] | J/mol×K | [743.51; 958.53] |
|
| Cp,gas | 720.49 | J/mol×K | 743.51 | Joback Calculated Property |
| Cp,gas | 740.51 | J/mol×K | 779.35 | Joback Calculated Property |
| Cp,gas | 759.11 | J/mol×K | 815.18 | Joback Calculated Property |
| Cp,gas | 776.33 | J/mol×K | 851.02 | Joback Calculated Property |
| Cp,gas | 792.18 | J/mol×K | 886.86 | Joback Calculated Property |
| Cp,gas | 806.70 | J/mol×K | 922.69 | Joback Calculated Property |
| Cp,gas | 819.91 | J/mol×K | 958.53 | Joback Calculated Property |
| η | [0.0002246; 0.0021980] | Pa×s | [416.96; 743.51] |
|
| η | 0.0021980 | Pa×s | 416.96 | Joback Calculated Property |
| η | 0.0012067 | Pa×s | 471.39 | Joback Calculated Property |
| η | 0.0007501 | Pa×s | 525.81 | Joback Calculated Property |
| η | 0.0005097 | Pa×s | 580.24 | Joback Calculated Property |
| η | 0.0003701 | Pa×s | 634.66 | Joback Calculated Property |
| η | 0.0002827 | Pa×s | 689.09 | Joback Calculated Property |
| η | 0.0002246 | Pa×s | 743.51 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, cyclobutyl isobutyl ester.
Sources
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