- InChI
- InChI=1S/C18H14O2/c1-13-6-2-5-9-17(13)18(19)20-16-11-10-14-7-3-4-8-15(14)12-16/h2-12H,1H3
- InChI Key
- LJIQFSNCVVGXSR-UHFFFAOYSA-N
- Formula
- C18H14O2
- SMILES
- Cc1ccccc1C(=O)Oc1ccc2ccccc2c1
- Molecular Weight1
- 262.30
- Other Names
-
- o-Toluylic acid, 2-naphthyl ester
- 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° | 178.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -18.46 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.33 | kJ/mol | Joback Calculated Property |
| log10WS | -5.84 | Crippen Calculated Property | |
| logPoct/wat | 4.367 | Crippen Calculated Property | |
| McVol | 204.940 | ml/mol | McGowan Calculated Property |
| Pc | 2443.48 | kPa | Joback Calculated Property |
| Inp | [2311.00; 2311.00] |
|
|
| Inp | 2311.00 | NIST | |
| Inp | 2311.00 | NIST | |
| Tboil | 769.83 | K | Joback Calculated Property |
| Tc | 1021.87 | K | Joback Calculated Property |
| Tfus | 475.36 | K | Joback Calculated Property |
| Vc | 0.773 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [555.08; 626.39] | J/mol×K | [769.83; 1021.87] |
|
| Cp,gas | 555.08 | J/mol×K | 769.83 | Joback Calculated Property |
| Cp,gas | 569.74 | J/mol×K | 811.84 | Joback Calculated Property |
| Cp,gas | 583.16 | J/mol×K | 853.84 | Joback Calculated Property |
| Cp,gas | 595.43 | J/mol×K | 895.85 | Joback Calculated Property |
| Cp,gas | 606.66 | J/mol×K | 937.86 | Joback Calculated Property |
| Cp,gas | 616.95 | J/mol×K | 979.87 | Joback Calculated Property |
| Cp,gas | 626.39 | J/mol×K | 1021.87 | Joback Calculated Property |
| η | [0.0001843; 0.0009517] | Pa×s | [475.36; 769.83] |
|
| η | 0.0009517 | Pa×s | 475.36 | Joback Calculated Property |
| η | 0.0006369 | Pa×s | 524.44 | Joback Calculated Property |
| η | 0.0004565 | Pa×s | 573.52 | Joback Calculated Property |
| η | 0.0003449 | Pa×s | 622.60 | Joback Calculated Property |
| η | 0.0002714 | Pa×s | 671.67 | Joback Calculated Property |
| η | 0.0002207 | Pa×s | 720.75 | Joback Calculated Property |
| η | 0.0001843 | Pa×s | 769.83 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to o-Toluic acid, 2-naphthyl ester.
Sources
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