- InChI
- InChI=1S/C17H32O4/c1-5-6-7-10-15(4)21-17(19)12-11-16(18)20-13-8-9-14(2)3/h14-15H,5-13H2,1-4H3
- InChI Key
- IIAWNYUCRAETCL-UHFFFAOYSA-N
- Formula
- C17H32O4
- SMILES
-
CCCCCC(C)OC(=O)CCC(=O)OCCCC(C)
C - Molecular Weight1
- 300.44
- 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 | 0.8558 | Relay (1.0) Calculated Property | |
| ΔfG° | -533.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1044.97 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 41.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.57 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.65 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.17 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.258 | Crippen Calculated Property | |
| McVol | 265.270 | ml/mol | McGowan Calculated Property |
| Pc | 1253.92 | kPa | Joback Calculated Property |
| Inp | [1919.00; 1919.00] |
|
|
| Inp | 1919.00 | NIST | |
| Inp | 1919.00 | NIST | |
| Tboil | 572.49 | K | Relay (1.0) Calculated Property |
| Tc | 745.51 | K | Relay (1.0) Calculated Property |
| Tfus | 243.24 | K | Relay (1.0) Calculated Property |
| Vc | 1.009 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [776.34; 868.73] | J/mol×K | [704.12; 879.41] |
|
| Cp,gas | 776.34 | J/mol×K | 704.12 | Joback Calculated Property |
| Cp,gas | 794.05 | J/mol×K | 733.33 | Joback Calculated Property |
| Cp,gas | 810.82 | J/mol×K | 762.55 | Joback Calculated Property |
| Cp,gas | 826.67 | J/mol×K | 791.76 | Joback Calculated Property |
| Cp,gas | 841.59 | J/mol×K | 820.98 | Joback Calculated Property |
| Cp,gas | 855.61 | J/mol×K | 850.19 | Joback Calculated Property |
| Cp,gas | 868.73 | J/mol×K | 879.41 | Joback Calculated Property |
| η | [0.0000558; 0.0041314] | Pa×s | [336.01; 704.12] |
|
| η | 0.0041314 | Pa×s | 336.01 | Joback Calculated Property |
| η | 0.0011590 | Pa×s | 397.36 | Joback Calculated Property |
| η | 0.0004568 | Pa×s | 458.71 | Joback Calculated Property |
| η | 0.0002243 | Pa×s | 520.06 | Joback Calculated Property |
| η | 0.0001279 | Pa×s | 581.42 | Joback Calculated Property |
| η | 0.0000812 | Pa×s | 642.77 | Joback Calculated Property |
| η | 0.0000558 | Pa×s | 704.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2-heptyl isohexyl ester.
Sources
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