- InChI
- InChI=1S/C15H24O4/c1-3-5-11-19-15(17)13-9-7-6-8-12(13)14(16)18-10-4-2/h4,12-13H,2-3,5-11H2,1H3
- InChI Key
- AYLHMZJHXHVOOV-UHFFFAOYSA-N
- Formula
- C15H24O4
- SMILES
- C=CCOC(=O)C1CCCCC1C(=O)OCCCC
- Molecular Weight1
- 268.35
- 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° | -287.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -683.12 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.75 | kJ/mol | Joback Calculated Property |
| log10WS | -3.09 | Crippen Calculated Property | |
| logPoct/wat | 2.865 | Crippen Calculated Property | |
| McVol | 221.930 | ml/mol | McGowan Calculated Property |
| Pc | 1807.70 | kPa | Joback Calculated Property |
| Inp | 1819.00 | NIST | |
| Tboil | 706.74 | K | Joback Calculated Property |
| Tc | 907.31 | K | Joback Calculated Property |
| Tfus | 404.51 | K | Joback Calculated Property |
| Vc | 0.837 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [649.85; 741.96] | J/mol×K | [706.74; 907.31] | 
|
| Cp,gas | 649.85 | J/mol×K | 706.74 | Joback Calculated Property |
| Cp,gas | 667.95 | J/mol×K | 740.17 | Joback Calculated Property |
| Cp,gas | 684.93 | J/mol×K | 773.60 | Joback Calculated Property |
| Cp,gas | 700.82 | J/mol×K | 807.03 | Joback Calculated Property |
| Cp,gas | 715.61 | J/mol×K | 840.46 | Joback Calculated Property |
| Cp,gas | 729.32 | J/mol×K | 873.88 | Joback Calculated Property |
| Cp,gas | 741.96 | J/mol×K | 907.31 | Joback Calculated Property |
| η | [0.0001427; 0.0015743] | Pa×s | [404.51; 706.74] |
|
| η | 0.0015743 | Pa×s | 404.51 | Joback Calculated Property |
| η | 0.0008455 | Pa×s | 454.88 | Joback Calculated Property |
| η | 0.0005140 | Pa×s | 505.25 | Joback Calculated Property |
| η | 0.0003420 | Pa×s | 555.62 | Joback Calculated Property |
| η | 0.0002435 | Pa×s | 606.00 | Joback Calculated Property |
| η | 0.0001826 | Pa×s | 656.37 | Joback Calculated Property |
| η | 0.0001427 | Pa×s | 706.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, allyl butyl ester.
Sources
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