- InChI
- InChI=1S/C16H16O2/c1-12-3-7-14(8-4-12)11-18-16(17)15-9-5-13(2)6-10-15/h3-10H,11H2,1-2H3
- InChI Key
- JSMHXVURHYHQGT-UHFFFAOYSA-N
- Formula
- C16H16O2
- SMILES
- Cc1ccc(COC(=O)c2ccc(C)cc2)cc1
- Molecular Weight1
- 240.30
- CAS
- 21086-87-3
- Other Names
-
- p-Toluic acid, p-methylbenzyl ester
- (4-Methylphenyl)methyl 4-methylbenzoate
- p-Methylbenzyl p-toluate
- 4-Methylbenzyl 4-methylbenzoate
- p-Toluic acid, p-xylyl ester
- (4-methylphenyl)methyl p-toluate
- 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).
- 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° | 55.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -168.25 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.24 | kJ/mol | Joback Calculated Property |
| log10WS | -4.78 | Crippen Calculated Property | |
| logPoct/wat | 3.660 | Crippen Calculated Property | |
| McVol | 196.220 | ml/mol | McGowan Calculated Property |
| Pc | 2320.31 | kPa | Joback Calculated Property |
| Tboil | 705.09 | K | Joback Calculated Property |
| Tc | 939.69 | K | Joback Calculated Property |
| Tfus | 420.12 | K | Joback Calculated Property |
| Vc | 0.740 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [517.05; 595.10] | J/mol×K | [705.09; 939.69] | 
|
| Cp,gas | 517.05 | J/mol×K | 705.09 | Joback Calculated Property |
| Cp,gas | 532.86 | J/mol×K | 744.19 | Joback Calculated Property |
| Cp,gas | 547.49 | J/mol×K | 783.29 | Joback Calculated Property |
| Cp,gas | 560.99 | J/mol×K | 822.39 | Joback Calculated Property |
| Cp,gas | 573.40 | J/mol×K | 861.49 | Joback Calculated Property |
| Cp,gas | 584.75 | J/mol×K | 900.59 | Joback Calculated Property |
| Cp,gas | 595.10 | J/mol×K | 939.69 | Joback Calculated Property |
| η | [0.0001219; 0.0009640] | Pa×s | [420.12; 705.09] |
|
| η | 0.0009640 | Pa×s | 420.12 | Joback Calculated Property |
| η | 0.0005733 | Pa×s | 467.62 | Joback Calculated Property |
| η | 0.0003752 | Pa×s | 515.11 | Joback Calculated Property |
| η | 0.0002638 | Pa×s | 562.61 | Joback Calculated Property |
| η | 0.0001959 | Pa×s | 610.10 | Joback Calculated Property |
| η | 0.0001519 | Pa×s | 657.59 | Joback Calculated Property |
| η | 0.0001219 | Pa×s | 705.09 | Joback Calculated Property |
Similar Compounds
![1,4-Benzenedicarboxylic acid, [4-(methoxycarbonyl)phenyl]methyl methyl ester.](data:image/png;base64,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)
Find more compounds similar to Benzoic acid, 4-methyl-, (4-methylphenyl)methyl ester.
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