- InChI
- InChI=1S/C16H28O4/c1-3-7-13(2)20-16(18)11-10-15(17)19-12-14-8-5-4-6-9-14/h13-14H,3-12H2,1-2H3
- InChI Key
- LEZSSQBDQMUNSR-UHFFFAOYSA-N
- Formula
- C16H28O4
- SMILES
- CCCC(C)OC(=O)CCC(=O)OCC1CCCCC1
- Molecular Weight1
- 284.39
- ω : Acentric Factor.
- 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).
- 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 | 0.7299 | Relay (1.0) Calculated Property | |
| ΔfG° | -361.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -969.17 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 31.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.32 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.49 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.72 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.622 | Crippen Calculated Property | |
| McVol | 240.320 | ml/mol | McGowan Calculated Property |
| Pc | 1667.33 | kPa | Joback Calculated Property |
| Inp | [1924.00; 1924.00] |
|
|
| Inp | 1924.00 | NIST | |
| Inp | 1924.00 | NIST | |
| Tboil | 599.58 | K | Relay (1.0) Calculated Property |
| Tc | 778.99 | K | Relay (1.0) Calculated Property |
| Tfus | 248.88 | K | Relay (1.0) Calculated Property |
| Vc | 0.885 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [729.43; 823.77] | J/mol×K | [737.17; 936.26] |
|
| Cp,gas | 729.43 | J/mol×K | 737.17 | Joback Calculated Property |
| Cp,gas | 748.04 | J/mol×K | 770.35 | Joback Calculated Property |
| Cp,gas | 765.47 | J/mol×K | 803.53 | Joback Calculated Property |
| Cp,gas | 781.74 | J/mol×K | 836.71 | Joback Calculated Property |
| Cp,gas | 796.88 | J/mol×K | 869.89 | Joback Calculated Property |
| Cp,gas | 810.88 | J/mol×K | 903.07 | Joback Calculated Property |
| Cp,gas | 823.77 | J/mol×K | 936.26 | Joback Calculated Property |
| η | [0.0000892; 0.0017773] | Pa×s | [406.78; 737.17] |
|
| η | 0.0017773 | Pa×s | 406.78 | Joback Calculated Property |
| η | 0.0008018 | Pa×s | 461.84 | Joback Calculated Property |
| η | 0.0004286 | Pa×s | 516.91 | Joback Calculated Property |
| η | 0.0002585 | Pa×s | 571.97 | Joback Calculated Property |
| η | 0.0001703 | Pa×s | 627.04 | Joback Calculated Property |
| η | 0.0001201 | Pa×s | 682.11 | Joback Calculated Property |
| η | 0.0000892 | Pa×s | 737.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, cyclohexylmethyl 2-pentyl ester.
Sources
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