- InChI
- InChI=1S/C23H38O3/c1-4-5-6-7-8-9-10-11-12-13-14-17-20(2)26-23(24)21-18-15-16-19-22(21)25-3/h15-16,18-20H,4-14,17H2,1-3H3
- InChI Key
- ACNRNCIIJZJUAX-UHFFFAOYSA-N
- Formula
- C23H38O3
- SMILES
-
CCCCCCCCCCCCCC(C)OC(=O)c1ccccc
1OC - Molecular Weight1
- 362.55
- 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° | -95.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -675.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.91 | kJ/mol | Joback Calculated Property |
| log10WS | -7.81 | Crippen Calculated Property | |
| logPoct/wat | 6.942 | Crippen Calculated Property | |
| McVol | 324.480 | ml/mol | McGowan Calculated Property |
| Pc | 1058.95 | kPa | Joback Calculated Property |
| Inp | [2558.00; 2558.00] |
|
|
| Inp | 2558.00 | NIST | |
| Inp | 2558.00 | NIST | |
| Tboil | 855.57 | K | Joback Calculated Property |
| Tc | 1052.74 | K | Joback Calculated Property |
| Tfus | 467.30 | K | Joback Calculated Property |
| Vc | 1.252 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1038.10; 1131.93] | J/mol×K | [855.57; 1052.74] |
|
| Cp,gas | 1038.10 | J/mol×K | 855.57 | Joback Calculated Property |
| Cp,gas | 1056.72 | J/mol×K | 888.43 | Joback Calculated Property |
| Cp,gas | 1074.10 | J/mol×K | 921.29 | Joback Calculated Property |
| Cp,gas | 1090.28 | J/mol×K | 954.15 | Joback Calculated Property |
| Cp,gas | 1105.30 | J/mol×K | 987.01 | Joback Calculated Property |
| Cp,gas | 1119.17 | J/mol×K | 1019.88 | Joback Calculated Property |
| Cp,gas | 1131.93 | J/mol×K | 1052.74 | Joback Calculated Property |
| η | [0.0000342; 0.0006224] | Pa×s | [467.30; 855.57] |
|
| η | 0.0006224 | Pa×s | 467.30 | Joback Calculated Property |
| η | 0.0002861 | Pa×s | 532.01 | Joback Calculated Property |
| η | 0.0001556 | Pa×s | 596.72 | Joback Calculated Property |
| η | 0.0000954 | Pa×s | 661.43 | Joback Calculated Property |
| η | 0.0000638 | Pa×s | 726.15 | Joback Calculated Property |
| η | 0.0000456 | Pa×s | 790.86 | Joback Calculated Property |
| η | 0.0000342 | Pa×s | 855.57 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to o-Anisic acid, 2-pentadecyl ester.
Sources
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