- InChI
- InChI=1S/C30H50O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-26-33-29(31)23-20-24-30(32)34-27-25-28-21-17-16-18-22-28/h16-18,21-22H,2-15,19-20,23-27H2,1H3
- InChI Key
- NUKQMRACJWVUMJ-UHFFFAOYSA-N
- Formula
- C30H50O4
- SMILES
-
CCCCCCCCCCCCCCCCCOC(=O)CCCC(=O
)OCCc1ccccc1 - Molecular Weight1
- 474.72
- 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 | 1.3235 | Relay (1.0) Calculated Property | |
| ΔfG° | -306.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1025.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 76.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 143.19 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.03 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.71 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.357 | Crippen Calculated Property | |
| McVol | 424.680 | ml/mol | McGowan Calculated Property |
| Pc | 708.46 | kPa | Joback Calculated Property |
| Inp | 3614.00 | NIST | |
| Tboil | 713.05 | K | Relay (1.0) Calculated Property |
| Tc | 901.21 | K | Relay (1.0) Calculated Property |
| Tfus | 302.53 | K | Relay (1.0) Calculated Property |
| Vc | 1.617 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1479.80; 1565.07] | J/mol×K | [1029.12; 1269.88] | 
|
| Cp,gas | 1479.80 | J/mol×K | 1029.12 | Joback Calculated Property |
| Cp,gas | 1498.71 | J/mol×K | 1069.25 | Joback Calculated Property |
| Cp,gas | 1515.61 | J/mol×K | 1109.37 | Joback Calculated Property |
| Cp,gas | 1530.60 | J/mol×K | 1149.50 | Joback Calculated Property |
| Cp,gas | 1543.77 | J/mol×K | 1189.63 | Joback Calculated Property |
| Cp,gas | 1555.23 | J/mol×K | 1229.75 | Joback Calculated Property |
| Cp,gas | 1565.07 | J/mol×K | 1269.88 | Joback Calculated Property |
| η | [0.0000089; 0.0002912] | Pa×s | [538.94; 1029.12] |
|
| η | 0.0002912 | Pa×s | 538.94 | Joback Calculated Property |
| η | 0.0001110 | Pa×s | 620.64 | Joback Calculated Property |
| η | 0.0000530 | Pa×s | 702.33 | Joback Calculated Property |
| η | 0.0000295 | Pa×s | 784.03 | Joback Calculated Property |
| η | 0.0000183 | Pa×s | 865.73 | Joback Calculated Property |
| η | 0.0000124 | Pa×s | 947.42 | Joback Calculated Property |
| η | 0.0000089 | Pa×s | 1029.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, heptadecyl phenethyl ester.
Sources
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