- InChI
- InChI=1S/C20H24O4/c1-14(2)15(3)23-19(21)12-7-13-20(22)24-18-11-6-9-16-8-4-5-10-17(16)18/h4-6,8-11,14-15H,7,12-13H2,1-3H3
- InChI Key
- NMEFZFITHGBCOR-UHFFFAOYSA-N
- Formula
- C20H24O4
- SMILES
-
CC(C)C(C)OC(=O)CCCC(=O)Oc1cccc
2ccccc12 - Molecular Weight1
- 328.40
- 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 | 0.8448 | Relay (1.0) Calculated Property | |
| ΔfG° | -145.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -704.13 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 36.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 103.33 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.01 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.41 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.503 | Crippen Calculated Property | |
| McVol | 264.320 | ml/mol | McGowan Calculated Property |
| Pc | 1640.43 | kPa | Joback Calculated Property |
| Inp | 2564.00 | NIST | |
| Tboil | 662.51 | K | Relay (1.0) Calculated Property |
| Tc | 902.46 | K | Relay (1.0) Calculated Property |
| Tfus | 333.41 | K | Relay (1.0) Calculated Property |
| Vc | 0.959 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [803.93; 876.70] | J/mol×K | [859.34; 1078.24] | 
|
| Cp,gas | 803.93 | J/mol×K | 859.34 | Joback Calculated Property |
| Cp,gas | 818.74 | J/mol×K | 895.82 | Joback Calculated Property |
| Cp,gas | 832.40 | J/mol×K | 932.31 | Joback Calculated Property |
| Cp,gas | 844.98 | J/mol×K | 968.79 | Joback Calculated Property |
| Cp,gas | 856.52 | J/mol×K | 1005.28 | Joback Calculated Property |
| Cp,gas | 867.07 | J/mol×K | 1041.76 | Joback Calculated Property |
| Cp,gas | 876.70 | J/mol×K | 1078.24 | Joback Calculated Property |
| η | [0.0000908; 0.0008512] | Pa×s | [501.12; 859.34] |
|
| η | 0.0008512 | Pa×s | 501.12 | Joback Calculated Property |
| η | 0.0004806 | Pa×s | 560.82 | Joback Calculated Property |
| η | 0.0003029 | Pa×s | 620.53 | Joback Calculated Property |
| η | 0.0002070 | Pa×s | 680.23 | Joback Calculated Property |
| η | 0.0001505 | Pa×s | 739.93 | Joback Calculated Property |
| η | 0.0001147 | Pa×s | 799.64 | Joback Calculated Property |
| η | 0.0000908 | Pa×s | 859.34 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 3-methylbut-2-yl 1-naphthyl ester.
Sources
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