- InChI
- InChI=1S/C22H26O4/c23-21(25-16-17-8-2-1-3-9-17)14-7-15-22(24)26-20-13-6-11-18-10-4-5-12-19(18)20/h4-6,10-13,17H,1-3,7-9,14-16H2
- InChI Key
- FWCVAQBMXYONRQ-UHFFFAOYSA-N
- Formula
- C22H26O4
- SMILES
-
O=C(CCCC(=O)Oc1cccc2ccccc12)OC
C1CCCCC1 - Molecular Weight1
- 354.44
- 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° | -99.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -516.56 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.89 | kJ/mol | Joback Calculated Property |
| log10WS | -6.29 | Crippen Calculated Property | |
| logPoct/wat | 5.039 | Crippen Calculated Property | |
| McVol | 281.640 | ml/mol | McGowan Calculated Property |
| Pc | 1636.45 | kPa | Joback Calculated Property |
| Inp | [3018.00; 3018.00] |
|
|
| Inp | 3018.00 | NIST | |
| Inp | 3018.00 | NIST | |
| Tboil | 925.53 | K | Joback Calculated Property |
| Tc | 1158.89 | K | Joback Calculated Property |
| Tfus | 561.04 | K | Joback Calculated Property |
| Vc | 1.062 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [913.94; 986.04] | J/mol×K | [925.53; 1158.89] |
|
| Cp,gas | 913.94 | J/mol×K | 925.53 | Joback Calculated Property |
| Cp,gas | 929.30 | J/mol×K | 964.42 | Joback Calculated Property |
| Cp,gas | 943.23 | J/mol×K | 1003.32 | Joback Calculated Property |
| Cp,gas | 955.79 | J/mol×K | 1042.21 | Joback Calculated Property |
| Cp,gas | 967.06 | J/mol×K | 1081.10 | Joback Calculated Property |
| Cp,gas | 977.11 | J/mol×K | 1120.00 | Joback Calculated Property |
| Cp,gas | 986.04 | J/mol×K | 1158.89 | Joback Calculated Property |
| η | [0.0000867; 0.0006764] | Pa×s | [561.04; 925.53] |
|
| η | 0.0006764 | Pa×s | 561.04 | Joback Calculated Property |
| η | 0.0004063 | Pa×s | 621.79 | Joback Calculated Property |
| η | 0.0002672 | Pa×s | 682.54 | Joback Calculated Property |
| η | 0.0001882 | Pa×s | 743.28 | Joback Calculated Property |
| η | 0.0001398 | Pa×s | 804.03 | Joback Calculated Property |
| η | 0.0001082 | Pa×s | 864.78 | Joback Calculated Property |
| η | 0.0000867 | Pa×s | 925.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, cyclohexylmethyl 1-naphthyl ester.
Sources
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