- InChI
- InChI=1S/C15H16O2/c1-15(2,3)14(16)17-13-9-8-11-6-4-5-7-12(11)10-13/h4-10H,1-3H3
- InChI Key
- SUGMMMOSTHSMJT-UHFFFAOYSA-N
- Formula
- C15H16O2
- SMILES
- CC(C)(C)C(=O)Oc1ccc2ccccc2c1
- Molecular Weight1
- 228.29
- 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° | 53.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -190.35 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.42 | kJ/mol | Joback Calculated Property |
| log10WS | -4.60 | Crippen Calculated Property | |
| logPoct/wat | 3.791 | Crippen Calculated Property | |
| McVol | 186.430 | ml/mol | McGowan Calculated Property |
| Pc | 2421.88 | kPa | Joback Calculated Property |
| Inp | 1756.00 | NIST | |
| Tboil | 666.30 | K | Joback Calculated Property |
| Tc | 901.26 | K | Joback Calculated Property |
| Tfus | 405.03 | K | Joback Calculated Property |
| Vc | 0.703 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [487.87; 566.05] | J/mol×K | [666.30; 901.26] | 
|
| Cp,gas | 487.87 | J/mol×K | 666.30 | Joback Calculated Property |
| Cp,gas | 503.59 | J/mol×K | 705.46 | Joback Calculated Property |
| Cp,gas | 518.11 | J/mol×K | 744.62 | Joback Calculated Property |
| Cp,gas | 531.52 | J/mol×K | 783.78 | Joback Calculated Property |
| Cp,gas | 543.92 | J/mol×K | 822.94 | Joback Calculated Property |
| Cp,gas | 555.40 | J/mol×K | 862.10 | Joback Calculated Property |
| Cp,gas | 566.05 | J/mol×K | 901.26 | Joback Calculated Property |
| η | [0.0002016; 0.0014197] | Pa×s | [405.03; 666.30] |
|
| η | 0.0014197 | Pa×s | 405.03 | Joback Calculated Property |
| η | 0.0008756 | Pa×s | 448.57 | Joback Calculated Property |
| η | 0.0005883 | Pa×s | 492.12 | Joback Calculated Property |
| η | 0.0004216 | Pa×s | 535.66 | Joback Calculated Property |
| η | 0.0003177 | Pa×s | 579.21 | Joback Calculated Property |
| η | 0.0002491 | Pa×s | 622.75 | Joback Calculated Property |
| η | 0.0002016 | Pa×s | 666.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,2-Dimethylpropanoic acid, 2-naphthyl ester.
Sources
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