- InChI
- InChI=1S/C23H28O4/c1-15(2)14-26-21(24)17-11-7-8-12-18(17)22(25)27-20-16(3)10-9-13-19(20)23(4,5)6/h7-13,15H,14H2,1-6H3
- InChI Key
- YCUVYUWMLDGLRM-UHFFFAOYSA-N
- Formula
- C23H28O4
- SMILES
-
Cc1cccc(C(C)(C)C)c1OC(=O)c1ccc
cc1C(=O)OCC(C)C - Molecular Weight1
- 368.47
- 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° | -128.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -583.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.96 | kJ/mol | Joback Calculated Property |
| log10WS | -6.60 | Crippen Calculated Property | |
| logPoct/wat | 5.325 | Crippen Calculated Property | |
| McVol | 302.290 | ml/mol | McGowan Calculated Property |
| Pc | 1381.96 | kPa | Joback Calculated Property |
| Inp | 2504.00 | NIST | |
| Tboil | 942.85 | K | Joback Calculated Property |
| Tc | 1174.13 | K | Joback Calculated Property |
| Tfus | 571.11 | K | Joback Calculated Property |
| Vc | 1.139 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [955.78; 1023.27] | J/mol×K | [942.85; 1174.13] | 
|
| Cp,gas | 955.78 | J/mol×K | 942.85 | Joback Calculated Property |
| Cp,gas | 970.29 | J/mol×K | 981.40 | Joback Calculated Property |
| Cp,gas | 983.41 | J/mol×K | 1019.94 | Joback Calculated Property |
| Cp,gas | 995.20 | J/mol×K | 1058.49 | Joback Calculated Property |
| Cp,gas | 1005.74 | J/mol×K | 1097.03 | Joback Calculated Property |
| Cp,gas | 1015.07 | J/mol×K | 1135.58 | Joback Calculated Property |
| Cp,gas | 1023.27 | J/mol×K | 1174.13 | Joback Calculated Property |
| η | [0.0000268; 0.0002810] | Pa×s | [571.11; 942.85] |
|
| η | 0.0002810 | Pa×s | 571.11 | Joback Calculated Property |
| η | 0.0001568 | Pa×s | 633.07 | Joback Calculated Property |
| η | 0.0000971 | Pa×s | 695.02 | Joback Calculated Property |
| η | 0.0000650 | Pa×s | 756.98 | Joback Calculated Property |
| η | 0.0000463 | Pa×s | 818.94 | Joback Calculated Property |
| η | 0.0000345 | Pa×s | 880.89 | Joback Calculated Property |
| η | 0.0000268 | Pa×s | 942.85 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, isobutyl 2-tert-butyl-6-methylphenyl ester.
Sources
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