- InChI
- InChI=1S/C22H28O4/c1-3-4-5-10-17(2)25-21(23)15-9-16-22(24)26-20-14-8-12-18-11-6-7-13-19(18)20/h6-8,11-14,17H,3-5,9-10,15-16H2,1-2H3
- InChI Key
- JLVZCTYKCTZIME-UHFFFAOYSA-N
- Formula
- C22H28O4
- SMILES
-
CCCCCC(C)OC(=O)CCCC(=O)Oc1cccc
2ccccc12 - Molecular Weight1
- 356.46
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -126.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -576.16 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.07 | kJ/mol | Joback Calculated Property |
| log10WS | -6.75 | Crippen Calculated Property | |
| logPoct/wat | 5.428 | Crippen Calculated Property | |
| McVol | 292.500 | ml/mol | McGowan Calculated Property |
| Pc | 1403.79 | kPa | Joback Calculated Property |
| Inp | [2770.00; 2770.00] |
|
|
| Inp | 2770.00 | NIST | |
| Inp | 2770.00 | NIST | |
| Tboil | 905.54 | K | Joback Calculated Property |
| Tc | 1121.21 | K | Joback Calculated Property |
| Tfus | 538.66 | K | Joback Calculated Property |
| Vc | 1.123 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [920.50; 994.66] | J/mol×K | [905.54; 1121.21] |
|
| Cp,gas | 920.50 | J/mol×K | 905.54 | Joback Calculated Property |
| Cp,gas | 935.52 | J/mol×K | 941.48 | Joback Calculated Property |
| Cp,gas | 949.40 | J/mol×K | 977.43 | Joback Calculated Property |
| Cp,gas | 962.20 | J/mol×K | 1013.37 | Joback Calculated Property |
| Cp,gas | 973.97 | J/mol×K | 1049.32 | Joback Calculated Property |
| Cp,gas | 984.77 | J/mol×K | 1085.26 | Joback Calculated Property |
| Cp,gas | 994.66 | J/mol×K | 1121.21 | Joback Calculated Property |
| η | [0.0000762; 0.0006454] | Pa×s | [538.66; 905.54] |
|
| η | 0.0006454 | Pa×s | 538.66 | Joback Calculated Property |
| η | 0.0003770 | Pa×s | 599.81 | Joback Calculated Property |
| η | 0.0002432 | Pa×s | 660.95 | Joback Calculated Property |
| η | 0.0001690 | Pa×s | 722.10 | Joback Calculated Property |
| η | 0.0001243 | Pa×s | 783.25 | Joback Calculated Property |
| η | 0.0000956 | Pa×s | 844.39 | Joback Calculated Property |
| η | 0.0000762 | Pa×s | 905.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, hept-2-yl 1-naphthyl ester.
Sources
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