- InChI
- InChI=1S/C21H30O5/c1-16(2)25-18-11-6-7-12-19(18)26-21(23)14-8-13-20(22)24-15-17-9-4-3-5-10-17/h6-7,11-12,16-17H,3-5,8-10,13-15H2,1-2H3
- InChI Key
- UZFIAJJCXGZJBK-UHFFFAOYSA-N
- Formula
- C21H30O5
- SMILES
-
CC(C)Oc1ccccc1OC(=O)CCCC(=O)OC
C1CCCCC1 - Molecular Weight1
- 362.46
- 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° | -322.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -824.49 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.04 | kJ/mol | Joback Calculated Property |
| log10WS | -5.56 | Crippen Calculated Property | |
| logPoct/wat | 4.673 | Crippen Calculated Property | |
| McVol | 292.880 | ml/mol | McGowan Calculated Property |
| Pc | 1445.73 | kPa | Joback Calculated Property |
| Inp | 2645.00 | NIST | |
| Tboil | 905.65 | K | Joback Calculated Property |
| Tc | 1126.16 | K | Joback Calculated Property |
| Tfus | 524.30 | K | Joback Calculated Property |
| Vc | 1.097 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [962.15; 1034.76] | J/mol×K | [905.65; 1126.16] | 
|
| Cp,gas | 962.15 | J/mol×K | 905.65 | Joback Calculated Property |
| Cp,gas | 978.31 | J/mol×K | 942.40 | Joback Calculated Property |
| Cp,gas | 992.82 | J/mol×K | 979.15 | Joback Calculated Property |
| Cp,gas | 1005.70 | J/mol×K | 1015.90 | Joback Calculated Property |
| Cp,gas | 1016.97 | J/mol×K | 1052.65 | Joback Calculated Property |
| Cp,gas | 1026.65 | J/mol×K | 1089.41 | Joback Calculated Property |
| Cp,gas | 1034.76 | J/mol×K | 1126.16 | Joback Calculated Property |
| η | [0.0000335; 0.0004710] | Pa×s | [524.30; 905.65] |
|
| η | 0.0004710 | Pa×s | 524.30 | Joback Calculated Property |
| η | 0.0002389 | Pa×s | 587.86 | Joback Calculated Property |
| η | 0.0001384 | Pa×s | 651.42 | Joback Calculated Property |
| η | 0.0000883 | Pa×s | 714.97 | Joback Calculated Property |
| η | 0.0000607 | Pa×s | 778.53 | Joback Calculated Property |
| η | 0.0000441 | Pa×s | 842.09 | Joback Calculated Property |
| η | 0.0000335 | Pa×s | 905.65 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, cyclohexylmethyl 2-isopropoxyphenyl ester.
Sources
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