- InChI
- InChI=1S/C17H24O4/c1-12(11-17(2,3)4)9-10-21-16(20)14-8-6-5-7-13(14)15(18)19/h5-8,12H,9-11H2,1-4H3,(H,18,19)
- InChI Key
- RJFYLVAMNLWRKY-UHFFFAOYSA-N
- Formula
- C17H24O4
- SMILES
-
CC(CCOC(=O)c1ccccc1C(=O)O)CC(C
)(C)C - Molecular Weight1
- 292.37
- CAS
- 297182-83-3
- 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° | -304.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -692.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.27 | kJ/mol | Joback Calculated Property |
| log10WS | -4.64 | Crippen Calculated Property | |
| logPoct/wat | 4.004 | Crippen Calculated Property | |
| McVol | 241.510 | ml/mol | McGowan Calculated Property |
| Pc | 1880.53 | kPa | Joback Calculated Property |
| Inp | 2213.00 | NIST | |
| Tboil | 838.69 | K | Joback Calculated Property |
| Tc | 1044.60 | K | Joback Calculated Property |
| Tfus | 490.62 | K | Joback Calculated Property |
| Vc | 0.911 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [737.20; 804.01] | J/mol×K | [838.69; 1044.60] | 
|
| Cp,gas | 737.20 | J/mol×K | 838.69 | Joback Calculated Property |
| Cp,gas | 750.52 | J/mol×K | 873.01 | Joback Calculated Property |
| Cp,gas | 762.90 | J/mol×K | 907.33 | Joback Calculated Property |
| Cp,gas | 774.39 | J/mol×K | 941.64 | Joback Calculated Property |
| Cp,gas | 785.04 | J/mol×K | 975.96 | Joback Calculated Property |
| Cp,gas | 794.90 | J/mol×K | 1010.28 | Joback Calculated Property |
| Cp,gas | 804.01 | J/mol×K | 1044.60 | Joback Calculated Property |
| η | [0.0000129; 0.0005837] | Pa×s | [490.62; 838.69] |
|
| η | 0.0005837 | Pa×s | 490.62 | Joback Calculated Property |
| η | 0.0002210 | Pa×s | 548.63 | Joback Calculated Property |
| η | 0.0001008 | Pa×s | 606.64 | Joback Calculated Property |
| η | 0.0000527 | Pa×s | 664.65 | Joback Calculated Property |
| η | 0.0000306 | Pa×s | 722.67 | Joback Calculated Property |
| η | 0.0000192 | Pa×s | 780.68 | Joback Calculated Property |
| η | 0.0000129 | Pa×s | 838.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-((3,5,5-Trimethylhexyloxy)carbonyl)benzoic acid.
Sources
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