- InChI
- InChI=1S/C16H26O4/c1-13(2)9-11-19-15(17)7-5-6-8-16(18)20-12-10-14(3)4/h1,3,5-12H2,2,4H3
- InChI Key
- CUSBMIUBCIBVOM-UHFFFAOYSA-N
- Formula
- C16H26O4
- SMILES
-
C=C(C)CCOC(=O)CCCCC(=O)OCCC(=C
)C - Molecular Weight1
- 282.38
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8186 | Relay (... Calculated Property | |
| ΔfG° | -225.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -833.54 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 37.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.47 | kJ/mol | Relay (... Calculated Property |
| IE | 9.03 | eV | Relay (... Calculated Property |
| log10WS | -3.28 | Relay (... Calculated Property | |
| logPoct/wat | 3.566 | Crippen Calculated Property | |
| McVol | 242.580 | ml/mol | McGowan Calculated Property |
| Pc | 1516.39 | kPa | Joback Calculated Property |
| Inp | [1919.00; 1919.00] |
|
|
| Inp | 1919.00 | NIST | |
| Inp | 1919.00 | NIST | |
| Tboil | 589.73 | K | Relay (... Calculated Property |
| Tc | 739.08 | K | Relay (... Calculated Property |
| Tfus | 258.94 | K | Relay (... Calculated Property |
| Vc | 0.894 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [683.97; 766.86] | J/mol×K | [711.18; 894.51] |
|
| Cp,gas | 683.97 | J/mol×K | 711.18 | Joback Calculated Property |
| Cp,gas | 699.78 | J/mol×K | 741.73 | Joback Calculated Property |
| Cp,gas | 714.77 | J/mol×K | 772.29 | Joback Calculated Property |
| Cp,gas | 728.95 | J/mol×K | 802.84 | Joback Calculated Property |
| Cp,gas | 742.35 | J/mol×K | 833.40 | Joback Calculated Property |
| Cp,gas | 754.98 | J/mol×K | 863.95 | Joback Calculated Property |
| Cp,gas | 766.86 | J/mol×K | 894.51 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, di(3-methylbut-3-enyl) ester.
Sources
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